Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.50 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL10367889 | 0.88 | IGF1R (0.42) | ESR1ESR2IGF1RALOX15 | |
| SCHEMBL13932020 | 0.85 | HPGD (0.57) | ESR1ESR2 | |
| SCHEMBL10503330 | 0.83 | SCN9A (0.45) | ESR1ESR2SCN9ACYP1A2CYP3A4 | |
| SCHEMBL10367659 | 0.83 | ESR1 (0.43) | ESR1ESR2SCN9ATAAR1 | |
| SCHEMBL10369583 | 0.80 | SCN9A (0.43) | ESR1ESR2SCN9ACYP1A2CYP3A4 | |
| Enazadrem SCHEMBL635505 | 0.79 | ESR1 (0.51) | ESR1ESR2 | |
| SCHEMBL10502715 | 0.79 | SCN9A (0.44) | ESR1ESR2SCN9ACYP1A2CYP3A4 | |
| SCHEMBL10503381 | 0.79 | SCN9A (0.44) | ESR1ESR2SCN9ACYP1A2CYP3A4 | |
| SCHEMBL6337120 | 0.75 | CA12 (0.52) | ESR1ESR2SCN9A | |
| Enazadrem SCHEMBL219332 | 0.74 | S1PR2 (0.49) | ESR1ESR2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0210044-B1 | HYDROXY AND ALKOXY PYRIMIDINES | PFIZER INC. (US) | 1990-08-29 | — | — | EP | claimed |
| US-4711888-A | Hydroxy and alkoxy pyrimidines | PFIZER INC. (US) | 1987-12-08 | — | — | US | claimed |
| EP-0210044-A2 | Hydroxy and alkoxy pyrimidines | PFIZER INC. (US) | 1987-01-28 | — | — | EP | claimed |
| EP-0210044-B1 | HYDROXY AND ALKOXY PYRIMIDINES | PFIZER INC. (US) | 1990-08-29 | — | — | EP | disclosed |
| US-4711888-A | Hydroxy and alkoxy pyrimidines | PFIZER INC. (US) | 1987-12-08 | — | — | US | disclosed |
| EP-0210044-A2 | Hydroxy and alkoxy pyrimidines | PFIZER INC. (US) | 1987-01-28 | — | — | EP | disclosed |