Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | ENPEP | Q07075 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | PLG | P00747 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | GSTK1 | Q9Y2Q3 | 2/20 | 0.54 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | BHMT | Q93088 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10872728 | 1.00 | ALDH1A1 (0.61) | ALDH1A1LMNANFKB1TSHRPMP22 | |
| SCHEMBL287721 | 1.00 | ALDH1A1 (0.61) | ALDH1A1LMNANFKB1TSHRPMP22 | |
| SCHEMBL500127 | 0.97 | ENPEP (0.61) | ALDH1A1LMNANFKB1TSHRPMP22 | |
| SCHEMBL288439 | 0.90 | — | — | |
| SCHEMBL9438366 | 0.89 | FOLH1 (0.56) | ALDH1A1LMNANFKB1TSHRPMP22 | |
| Sebacic Acid SCHEMBL2190152 | 0.89 | FFAR4 (0.69) | ALDH1A1LMNATSHRMEN1ALOX15 | |
| Dodecanoate SCHEMBL31306299 | 0.89 | FFAR4 (0.69) | ALDH1A1LMNATSHRMEN1ALOX15 | |
| Decanoic Acid SCHEMBL31208552 | 0.89 | FFAR4 (0.69) | ALDH1A1LMNATSHRMEN1ALOX15 | |
| Adipic Acid SCHEMBL10398140 | 0.89 | FFAR4 (0.69) | ALDH1A1LMNATSHRMEN1ALOX15 | |
| Dodecanoate SCHEMBL31306310 | 0.89 | FFAR4 (0.69) | ALDH1A1LMNATSHRMEN1ALOX15 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2499148-A2 | CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS | Polyphor Ag (CH) | 2012-09-19 | — | — | EP | claimed |
| CN-102317464-A | From alpha-ketoacid biosynthesizing difunctionality alkane | CELEXION LLC | 2012-01-11 | — | — | CN | claimed |
| WO-2011014973-A2 | CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS | POLYPHOR AG (CH) | 2011-02-10 | — | — | WO | claimed |
| US-5352453-A | Acidic ph | BOEHRINGER MANNHEIM GMBH (DE) | 1994-10-04 | — | — | US | claimed |
| EP-4392071-A1 | METHOD OF SYNTHESIZING DENDRIMERIC AMPHIPHILE | Kaohsiung Medical University (TW) | 2024-07-03 | — | — | EP | disclosed |
| WO-2023023889-A1 | METHOD OF SYNTHESIZING DENDRIMERIC AMPHIPHILE | KAOHSIUNG MEDICAL UNIVERSITY (CN) | 2023-03-02 | — | — | WO | disclosed |
| EP-2427476-A1 | BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY | Polyphor Ag (CH) | 2012-03-14 | — | — | EP | disclosed |
| CN-102317464-A | From alpha-ketoacid biosynthesizing difunctionality alkane | CELEXION LLC | 2012-01-11 | — | — | CN | disclosed |
| EP-2366026-A2 | BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL ALKANES FROM ALPHA KETOACIDS | Celexion, Llc (US) | 2011-09-21 | — | — | EP | disclosed |
| WO-2010127704-A1 | BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY | POLYPHOR AG (CH) | 2010-11-11 | — | — | WO | disclosed |
| WO-2010068944-A2 | BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL ALKANES FROM CARBOHYDRATE FEEDSTOCKS | CELEXION, LLC (US) | 2010-06-17 | — | — | WO | disclosed |
| EP-1261611-A2 | INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE | Bristol-Myers Squibb Pharma Company (US) | 2002-12-04 | — | — | EP | disclosed |
| EP-1196436-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | Bristol-Myers Squibb Pharma Company (US) | 2002-04-17 | — | — | EP | disclosed |
| WO-2001064678-A2 | INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-09-07 | — | — | WO | disclosed |
| WO-2001002424-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | DU PONT PHARMACEUTICALS COMPANY (US) | 2001-01-11 | — | — | WO | disclosed |