Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 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 | |
|---|---|---|---|---|
| SCHEMBL11271918 | 0.80 | MMP2 (0.49) | KDM4CMAPTRAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL11304375 | 0.80 | DDAH1 (0.49) | CYP17A1CYP11B1CYP11B2MAPTRAB9A | |
| Water SCHEMBL11275606 | 0.79 | MMP2 (0.48) | KDM4CMAPTRAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL11273141 | 0.77 | CYP1A2 (0.46) | KDM4CCYP17A1CYP11B1CYP11B2MAPT | |
| SCHEMBL11268741 | 0.77 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2RAB9APDE3B | |
| SCHEMBL11261944 | 0.77 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2RAB9AGABRA1 | |
| Hydrochloric Acid SCHEMBL11258775 | 0.75 | CYP17A1 (0.44) | CYP17A1CYP11B1CYP11B2RAB9AGABRA1 | |
| SCHEMBL20424556 | 0.75 | ALDH1A1 (0.49) | KDM4CMAPTKDM4EHPGD | |
| SCHEMBL20436746 | 0.74 | KDM4C (0.43) | KDM4CMAPTRAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL23589337 | 0.73 | SMN1; SMN2 (0.45) | KDM4CMAPTRAB9AKDM4ESMN1; SMN2 |
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-0055453-A2 | 5-(Pyridinyl)-benzimidazole derivatives and preparation | STERLING DRUG INC. (US) | 1982-07-07 | — | — | EP | disclosed |
| US-4335132-A | 5-(Py-Y)-1H-benzimidazol-2-ols and 5-(Py-Y-)-1H-benzimidazole-2-thiols | STERLING DRUG, INC. (US) | 1982-06-15 | — | — | US | disclosed |