Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690618 | 0.80 | MEN1 (0.42) | KDM4ECYP1A2CYP2C19CYP2D6KMT2A | |
| SCHEMBL10690077 | 0.78 | KMT2A (0.30) | ALDH1A1HPGDCYP1A2KMT2ALMNA | |
| SCHEMBL11876880 | 0.77 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDMAPK1CYP1A2 | |
| SCHEMBL10693113 | 0.77 | KCNH2 (0.36) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL10695710 | 0.77 | PDE10A (0.39) | ALDH1A1KDM4EHPGDMAPK1CYP1A2 | |
| SCHEMBL10691690 | 0.77 | KCNH2 (0.39) | ALDH1A1KDM4EHPGDCYP1A2CYP2C9 | |
| SCHEMBL10694763 | 0.76 | KDM4E (0.33) | ALDH1A1KDM4EHPGDCYP1A2MAPT | |
| SCHEMBL10693333 | 0.76 | IDH1 (0.36) | MAPK1CYP1A2CYP2C9CYP2D6LMNA | |
| SCHEMBL10693958 | 0.75 | SCN5A (0.36) | ALDH1A1KDM4EMAPK1CYP1A2CYP2C9 | |
| SCHEMBL10457804 | 0.74 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDMAPK1CYP1A2 |
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-0251012-A2 | N-sulfenyl-2-trifluoromethyl benzimidazoles | BAYER AG (DE) | 1988-01-07 | — | — | EP | disclosed |