Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12618409 | 0.91 | ESR1 (0.40) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL12320786 | 0.86 | ESR1 (0.45) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL18890640 | 0.78 | ALDH1A1 (0.50) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1801134 | 0.76 | ESR1 (0.47) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1799546 | 0.76 | MAPT (0.50) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1801701 | 0.75 | ESR1 (0.43) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1797688 | 0.74 | CHEK2 (0.52) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1799498 | 0.72 | TP53 (0.48) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL1801947 | 0.71 | ALDH1A1 (0.41) | ESR1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL34467256 | 0.71 | CHEK2 (0.64) | ESR1ALDH1A1HPGDSMN1; SMN2POLB |
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-1911755-B1 | BENZOIMIDAZOLE COMPOUND CAPABLE OF INHIBITING PROSTAGLANDIN D SYNTHETASE | TAIHO PHARMACEUTICAL CO LTD (JP) | 2011-09-14 | — | — | EP | disclosed |
| EP-1911755-A1 | BENZOIMIDAZOLE COMPOUND CAPABLE OF INHIBITING PROSTAGLANDIN D SYNTHETASE | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2008-04-16 | — | — | EP | disclosed |