Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | CTSA | P10619 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.42 |
| ▸ | PDE4A | P27815 | 3/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 5/20 | 0.39 |
| ▸ | TUBB | P07437 | 5/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 5/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 5/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 5/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 5/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 5/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 5/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 5/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29353186 | 1.00 | ALOX5AP (0.45) | ALOX5APFEN1CTSAPDE4BPDE4A | |
| SCHEMBL10336282 | 0.85 | ALDH1A1 (0.40) | CTSAGRM5TUBB4ATUBBTUBA3C | |
| SCHEMBL13385087 | 0.85 | PDE4B (0.48) | ALOX5APFEN1PDE4BPDE4APDE4C | |
| SCHEMBL12999417 | 0.85 | CA12 (0.41) | CTSAGRM5TUBB4ATUBBTUBA3C | |
| SCHEMBL29997699 | 0.79 | ALDH1A1 (0.43) | CTSAALDH1A1NPSR1GCK | |
| SCHEMBL23226735 | 0.79 | DRD1 (0.45) | CTSACYP2A6TUBB4ATUBBTUBA3C | |
| SCHEMBL18038841 | 0.79 | SMARCA2 (0.54) | ALOX5APFEN1CTSAALDH1A1MAPT | |
| Methoxymethane SCHEMBL29002659 | 0.79 | MEN1 (0.44) | CYP2A6ALDH1A1MAPTHTTNPSR1 | |
| SCHEMBL5549968 | 0.78 | ALOX5AP (0.55) | ALOX5APFEN1PDE4BPDE4APDE4C | |
| SCHEMBL28054908 | 0.78 | HTR1A (0.46) | CYP2A6FFAR4ALDH1A1MAPTHTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1034164-B1 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2004-05-19 | — | — | EP | claimed |
| EP-1034164-A4 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2001-07-11 | — | — | EP | claimed |
| EP-1034164-A1 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (US) | 2000-09-13 | — | — | EP | claimed |
| WO-1999026921-A1 | SUBSTITUTED β-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1999-06-03 | — | — | WO | claimed |
| CN-110431136-A | Material for organic electroluminescence device | MERCK PATENT GMBH | 2019-11-08 | — | — | CN | disclosed |
| CN-106661006-B | Material for organic electroluminescence device | 默克专利有限公司 | 2019-11-08 | — | — | CN | disclosed |
| CN-106661007-B | Material for organic electroluminescence device | 默克专利有限公司 | 2019-08-13 | — | — | CN | disclosed |
| CN-109890813-A | Material for organic electroluminescence device | 默克专利有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-107683281-A | Material for organic electroluminescence device | 默克专利有限公司 | 2018-02-09 | — | — | CN | disclosed |
| CN-106661006-A | Materials for organic electroluminescent devices | 默克专利有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-106661007-A | Materials for organic electroluminescent devices | 默克专利有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-106459018-A | Material for organic light emitting device | 默克专利有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-103965133-A | N, S heterocycle-containing compound having DHODH inhibition activity, preparation and use thereof | UNIV EAST CHINA SCIENCE & TECH | 2014-08-06 | — | — | CN | disclosed |
| CN-103180300-A | Process for producing pyridazinone compound and intermediate thereof | SUMITOMO CHEMICAL CO | 2013-06-26 | — | — | CN | disclosed |
| EP-1034164-B1 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2004-05-19 | — | — | EP | disclosed |
| US-6645939-B1 | Very late antigen-4 (VLA) integrin antagonists; antiallergens, antiasthmatics, and antiinflammatory agents; multiple sclerosis, autoimmune disease treatment | MERCK & CO., INC. | 2003-11-11 | — | — | US | disclosed |
| EP-1034164-A4 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2001-07-11 | — | — | EP | disclosed |
| WO-2000071572-A1 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 2000-11-30 | — | — | WO | disclosed |
| EP-1034164-A1 | SUBSTITUTED BETA-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (US) | 2000-09-13 | — | — | EP | disclosed |
| WO-1999026921-A1 | SUBSTITUTED β-ALANINE DERIVATIVES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1999-06-03 | — | — | WO | disclosed |