Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | FNTA | P49354 | 14/20 | 0.35 |
| ▸ | FNTB | P49356 | 14/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | PGGT1B | P53609 | 5/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | MC4R | P32245 | 2/20 | 0.31 |
| ▸ | MC1R | Q01726 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5758460 | 0.94 | FNTA (0.38) | CYP19A1FNTAFNTBKCNH2PGGT1B | |
| SCHEMBL4405093 | 0.80 | FNTA (0.40) | CYP19A1FNTAFNTBKCNH2PGGT1B | |
| SCHEMBL2381616 | 0.77 | FNTA (0.47) | CYP19A1FNTAFNTBKCNH2PGGT1B | |
| SCHEMBL445939 | 0.74 | FNTA (0.51) | CYP19A1FNTAFNTBPGGT1BMC4R | |
| SCHEMBL5131468 | 0.74 | FNTA (0.51) | CYP19A1FNTAFNTBPGGT1BMC4R | |
| Hydrochloric Acid SCHEMBL8541088 | 0.73 | FNTA (0.51) | CYP19A1FNTAFNTBPGGT1BMC4R | |
| Hydrochloric Acid SCHEMBL8160943 | 0.73 | FNTA (0.51) | CYP19A1FNTAFNTBPGGT1BMC4R | |
| SCHEMBL3517007 | 0.73 | FNTA (0.50) | CYP19A1FNTAFNTBKCNH2PGGT1B | |
| Trifluoroacetic Acid SCHEMBL8162228 | 0.73 | FNTA (0.43) | CYP19A1FNTAFNTBKCNH2PGGT1B | |
| SCHEMBL3687066 | 0.71 | FNTA (0.59) | CYP19A1FNTAFNTBKCNH2PGGT1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1226119-A4 | TYROSINE KINASE INHIBITORS | MERCK & CO INC (US) | 2003-04-09 | — | — | EP | disclosed |
| EP-1226119-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO. INC. (US) | 2002-07-31 | — | — | EP | disclosed |
| WO-2001028993-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO. INC. (US) | 2001-04-26 | — | — | WO | disclosed |