Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7377000 | 0.89 | CYP19A1 (0.52) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL7743982 | 0.88 | ALDH1A1 (0.64) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL7372952 | 0.85 | CYP19A1 (0.55) | NPC1MAPTRAB9AKEAP1NFE2L2 | |
| SCHEMBL7341942 | 0.82 | NPC1 (0.47) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL27503155 | 0.80 | CYP19A1 (0.50) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL7377323 | 0.80 | CYP19A1 (0.46) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL7376472 | 0.79 | HSD17B1 (0.49) | NPC1MAPTHPGDHTTRAB9A | |
| SCHEMBL7344542 | 0.79 | MAPT (0.48) | NPC1ALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL7375995 | 0.79 | CYP19A1 (0.51) | NPC1ALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL7338948 | 0.78 | CYP19A1 (0.53) | NPC1ALDH1A1RAB9ASMN1; SMN2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6211242-B1 | CARDIOVASCULAR DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-04-03 | — | — | US | disclosed |
| EP-0757670-B1 | BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO (JP) | 1999-01-13 | — | — | EP | disclosed |
| WO-1995029152-A1 | BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-11-02 | — | — | WO | disclosed |