Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11987671 | 0.85 | MEN1 (0.42) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL320584 | 0.80 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1TDP1HSP90AA1 | |
| SCHEMBL96214 | 0.78 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1TDP1HSP90AA1 | |
| SCHEMBL20818488 | 0.78 | ERN1 (0.39) | ALDH1A1KMT2AMEN1TDP1POLB | |
| SCHEMBL18797733 | 0.76 | ALDH1A1 (0.35) | ALDH1A1KMT2AMEN1TDP1CYP2A6 | |
| SCHEMBL28806185 | 0.75 | ALDH1A1 (0.94) | ALDH1A1KMT2AMEN1TDP1HSP90AA1 | |
| SCHEMBL29792815 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1TDP1TRPV4 | |
| SCHEMBL16974757 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1TDP1TRPV4 | |
| SCHEMBL16797148 | 0.72 | CYP1A2 (0.42) | ALDH1A1KMT2AMEN1TDP1CYP1A2 | |
| SCHEMBL154430 | 0.72 | ALDH1A1 (0.70) | ALDH1A1KMT2AMEN1TDP1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015052675-A1 | SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2015-04-16 | — | — | WO | disclosed |