Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 13/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29374849 | 0.86 | MAOA (0.68) | OPRM1MAOAMAOBTAAR1DPP4 | |
| SCHEMBL3421920 | 0.85 | MAOA (0.73) | TACR1OPRM1MAOAMAOBTAAR1 | |
| SCHEMBL10208913 | 0.82 | DPP4 (0.70) | MAOAMAOBTAAR1DPP4SLC6A4 | |
| SCHEMBL21770897 | 0.81 | TACR1 (0.53) | TACR1OPRM1MAOAMAOBTAAR1 | |
| SCHEMBL8369864 | 0.81 | TACR1 (0.53) | TACR1OPRM1MAOAMAOBTAAR1 | |
| SCHEMBL2864514 | 0.81 | DPP4 (0.68) | MAOAMAOBTAAR1DPP4SLC6A4 | |
| Hydrochloric Acid SCHEMBL10669389 | 0.79 | DPP4 (0.66) | MAOAMAOBTAAR1DPP4SLC6A4 | |
| SCHEMBL5266493 | 0.79 | TACR1 (0.55) | TACR1OPRM1HTR2ASLC6A4KCNH2 | |
| SCHEMBL15577184 | 0.78 | MAOA (0.52) | OPRM1MAOAMAOBTAAR1DPP4 | |
| SCHEMBL15577225 | 0.78 | MAOA (0.52) | OPRM1MAOAMAOBTAAR1DPP4 |
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-1198464-A1 | 8-PHENYL-6,9-DIHYDRO- 1,2,4]TRIAZOLO 3,4- i i /i ]PURIN-5-ONE DERIVATIVES | Almirall Prodesfarma, S.A. (ES) | 2002-04-24 | — | — | EP | disclosed |
| WO-2001007441-A1 | 8-PHENYL-6,9-DIHYDRO-[1,2,4]TRIAZOLO[3,4-i]PURIN-5-ONE DERIVATIVES | ALMIRALL PRODESFARMA S.A. (ES) | 2001-02-01 | — | — | WO | disclosed |