Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.37 |
| ▸ | F9 | P00740 | 1/20 | 0.36 |
| ▸ | BRS3 | P32247 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10896025 | 0.89 | IDO1 (0.53) | IDO1MAOBPDE10ANPBWR1KCNH2 | |
| SCHEMBL3372786 | 0.86 | MAOB (0.46) | IDO1MAOBPDE10ANPBWR1CACNA1H | |
| SCHEMBL3423976 | 0.84 | MAOB (0.46) | IDO1MAOBPDE10ANPBWR1CACNA1H | |
| SCHEMBL9597974 | 0.82 | PDE10A (0.47) | IDO1MAOBPDE10ANPBWR1CACNA1H | |
| SCHEMBL4556153 | 0.82 | TDP1 (0.47) | IDO1MAOBPDE10ANPBWR1CACNA1H | |
| SCHEMBL10896012 | 0.82 | MAOB (0.46) | IDO1MAOBPDE10ACACNA1HKDM4E | |
| Lithium Ion SCHEMBL3423977 | 0.81 | MAOB (0.45) | IDO1MAOBPDE10ACACNA1HKDM4E | |
| SCHEMBL5681369 | 0.80 | RAD52 (0.51) | IDO1PDE10ACACNA1HKDM4ENTRK1 | |
| SCHEMBL367831 | 0.79 | IDO1 (0.45) | IDO1PDE10ANPBWR1CACNA1HKDM4E | |
| SCHEMBL10284701 | 0.79 | DDAH1 (0.53) | IDO1PDE10ANPBWR1CACNA1HKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4612049-A | BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID | CIBA-GEIGY CORPORATION (US) | 1986-09-16 | — | — | US | disclosed |