Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6734487 | 1.00 | ALDH1A1 (0.40) | ALDH1A1ADRA2BTDP1PTGS1MEN1 | |
| SCHEMBL12820840 | 1.00 | ALDH1A1 (0.40) | ALDH1A1ADRA2BTDP1PTGS1MEN1 | |
| SCHEMBL7396650 | 0.80 | PPARG (0.35) | ALDH1A1ADRA2BTDP1PTGS1ADRA2A | |
| SCHEMBL7396639 | 0.80 | PPARG (0.35) | ALDH1A1ADRA2BTDP1PTGS1ADRA2A | |
| SCHEMBL7399647 | 0.79 | ADRA2B (0.42) | ALDH1A1ADRA2BTDP1PTGS1MEN1 | |
| SCHEMBL7399658 | 0.79 | ADRA2B (0.42) | ALDH1A1ADRA2BTDP1PTGS1MEN1 | |
| SCHEMBL12763871 | 0.77 | ALDH1A1 (0.46) | ALDH1A1ADRA2BTDP1MEN1KMT2A | |
| SCHEMBL6076524 | 0.77 | ALDH1A1 (0.46) | ALDH1A1ADRA2BTDP1MEN1KMT2A | |
| SCHEMBL6076526 | 0.77 | ALDH1A1 (0.46) | ALDH1A1ADRA2BTDP1MEN1KMT2A | |
| SCHEMBL15668235 | 0.76 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2ALMNACYP3A4 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6683213-B1 | CHEMICAL INTERMEDIATES FOR PYRIDINEDICARBOXAMIDE HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2004-01-27 | — | — | US | disclosed |
| EP-1165496-B1 | SUBSTITUTED ANILINE COMPOUNDS | BASF AG (DE) | 2003-07-09 | — | — | EP | disclosed |
| CN-1345304-A | Substituted aniline compounds | BASF AG (DE) | 2002-04-17 | — | — | CN | disclosed |
| EP-1165496-A1 | SUBSTITUTED ANILINE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000059868-A1 | SUBSTITUTED ANILINE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 2000-10-12 | — | — | WO | disclosed |
| US-5330990-A | Antagonists of 5-HT and 5-HT3 receptors, psychological disorders, antinausea | NOVO NORDISK A/S (DK) | 1994-07-19 | — | — | US | disclosed |
| EP-0419397-B1 | Substituted urea compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-06-08 | — | — | EP | disclosed |
| EP-0491770-A1 | SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1992-07-01 | — | — | EP | disclosed |
| EP-0419397-A1 | Substituted urea compounds and their preparation and use | NOVO NORDISK A/S (DK) | 1991-03-27 | — | — | EP | disclosed |
| WO-1991003475-A1 | SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1991-03-21 | — | — | WO | disclosed |