Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8916927 | 0.88 | PTPN1 (0.40) | ALDH1A1GAAHTTKDM4EL3MBTL1 | |
| SCHEMBL30228418 | 0.84 | ALDH1A1 (0.49) | CYP11B1CYP11B2CYP19A1CYP17A1MAOB | |
| SCHEMBL8812194 | 0.82 | KDR (0.48) | ACVR1SLC6A4HTR3AHTR1A | |
| SCHEMBL8917934 | 0.82 | MAPT (0.39) | MAOBALDH1A1HTTKDM4EPHGDH | |
| SCHEMBL8917729 | 0.73 | PRKDC (0.45) | ALDH1A1KDM4EPHGDHRAB9A | |
| SCHEMBL1447764 | 0.72 | ALDH1A1 (0.43) | ALDH1A1GAAHTTL3MBTL1PHGDH | |
| SCHEMBL8917899 | 0.70 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP19A1CYP17A1MCHR1 | |
| SCHEMBL3556088 | 0.70 | KDR (0.51) | ACVR1SLC6A4HTR3APTPN1HTR1A | |
| SCHEMBL8917207 | 0.70 | ALDH1A1 (0.35) | ALDH1A1KDM4EHTR3AHPGDSMN1; SMN2 | |
| SCHEMBL4142914 | 0.69 | DRD2 (0.45) | ALDH1A1GAAHTTL3MBTL1DRD2 |
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-5532240-A | ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1996-07-02 | — | — | US | claimed |
| US-5691330-A | ANTIPSYCHOTIC AGENT | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5532240-A | ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1996-07-02 | — | — | US | disclosed |