Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | CASP3 | P42574 | 3/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31090827 | 1.00 | CYP19A1 (0.50) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL22347748 | 1.00 | CYP19A1 (0.50) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL29664559 | 0.74 | CYP19A1 (0.86) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL2774526 | 0.74 | CYP19A1 (0.86) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL2774532 | 0.74 | CYP19A1 (0.86) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL2409197 | 0.74 | LCK (0.53) | MAOAMAOBNPC1MAPTGFER | |
| SCHEMBL2409195 | 0.74 | LCK (0.53) | MAOAMAOBNPC1MAPTGFER | |
| SCHEMBL8868928 | 0.71 | CYP19A1 (0.67) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL8868935 | 0.71 | CYP19A1 (0.67) | CYP19A1MAOAMAOBNPC1MAPT | |
| SCHEMBL11288405 | 0.70 | CYP19A1 (0.91) | CYP19A1MAOAMAOBNPC1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3924329-A2 | SUBSTITUTED AMIDE COMPOUNDS USEFUL AS FARNESOID X RECEPTOR MODULATORS | Bristol-Myers Squibb Company (US) | 2021-12-22 | — | — | EP | disclosed |
| WO-2020168152-A2 | SUBSTITUTED AMIDE COMPOUNDS USEFUL AS FARNESOID X RECEPTOR MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2020-08-20 | — | — | WO | disclosed |