Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 1/20 | 0.35 |
| ▸ | TSPO | P30536 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5659575 | 0.85 | CYP19A1 (0.42) | CYP19A1THRATHRBSMN1; SMN2MEN1 | |
| SCHEMBL1943120 | 0.74 | CTSV (0.42) | CYP19A1MEN1KMT2AALDH1A1HTR1A | |
| SCHEMBL16342378 | 0.70 | LMNA (0.48) | CYP19A1THRATHRBSMN1; SMN2MEN1 | |
| SCHEMBL7978965 | 0.69 | MEN1 (0.39) | CYP19A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL7978956 | 0.68 | CYP19A1 (0.45) | CYP19A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL7965562 | 0.68 | TSPO (0.46) | CYP19A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL5656398 | 0.67 | CYP19A1 (0.43) | CYP19A1THRATHRBMEN1KMT2A | |
| SCHEMBL5579908 | 0.67 | TSPO (0.43) | CYP19A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL30510897 | 0.67 | CYP19A1 (0.43) | CYP19A1THRATHRBSMN1; SMN2MEN1 | |
| SCHEMBL26039527 | 0.67 | CYP19A1 (0.43) | CYP19A1THRATHRBSMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2081939-B1 | BENZIMIDAZOLE DERIVATIVES AS SELECTIVE ACID PUMP INHIBITORS | RAQUALIA PHARMA INC (JP) | 2011-06-15 | — | — | EP | disclosed |