Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | GHSR | Q92847 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 4/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | PKLR | P30613 | 1/20 | 0.33 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.33 |
| ▸ | CHRNG | P07510 | 2/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9231150 | 0.88 | OPRL1 (0.35) | OPRL1MEN1CYP1A2MAPTCYP2C19 | |
| SCHEMBL9230320 | 0.86 | OPRL1 (0.38) | BRD4OPRL1CYP1A2OTUD7B | |
| SCHEMBL9225503 | 0.83 | AKR1C3 (0.47) | AKR1C3HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL9043134 | 0.78 | MAPT (0.36) | HTR1AHTR2AHTR7HTR6GHSR | |
| SCHEMBL9231680 | 0.76 | CCR1 (0.33) | OPRL1CYP1A2MAPTCYP2C19OTUD7B | |
| SCHEMBL9231434 | 0.76 | L3MBTL1 (0.34) | PKLROTUD7B | |
| SCHEMBL11869473 | 0.74 | AKR1C3 (0.51) | AKR1C3HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL9232012 | 0.74 | AKR1C3 (0.56) | AKR1C3HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL9231114 | 0.72 | AKR1C3 (0.42) | AKR1C3HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL9230546 | 0.72 | LMNA (0.43) | AKR1C3BRD4OPRL1MEN1MAPT |
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-0640087-A1 | USE OF TRICYCLIC PYRIMIDINE DERIVATIVES AS ANTI-VIRAL MEDICAMENTS | Roche Diagnostics GmbH (DE) | 1995-03-01 | — | — | EP | disclosed |
| WO-1993023405-A1 | USE OF TRICYCLIC PYRIMIDINE DERIVATIVES AS ANTI-VIRAL MEDICAMENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1993-11-25 | — | — | WO | disclosed |