Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL16634734 | 0.83 | DAO (0.50) | DAOSMN1; SMN2KDM4EFEN1CYP3A4 | |
| SCHEMBL16634795 | 0.70 | DAO (0.44) | DAOFEN1HSP90AA1 | |
| SCHEMBL16634807 | 0.70 | CACNA1H (0.34) | SMN1; SMN2ALDH1A1KMT2AGABRA1GABRG2 | |
| SCHEMBL4208340 | 0.68 | CES2 (0.53) | KMT2AGABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL30208191 | 0.68 | CES2 (0.53) | KMT2AGABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL27903519 | 0.67 | GABRA1 (0.43) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL16634626 | 0.67 | HSP90AA1 (0.54) | DAOSMN1; SMN2KDM4EGABRA1GABRG2 | |
| SCHEMBL30289054 | 0.66 | GABRA1 (0.50) | KDM4EALDH1A1KMT2AGABRA1GABRG2 | |
| SCHEMBL30796039 | 0.66 | L3MBTL1 (0.59) | SMN1; SMN2ALDH1A1KMT2ANPC1GAA | |
| SCHEMBL31587898 | 0.66 | CA12 (0.46) | SMN1; SMN2KDM4EALDH1A1KMT2AGABRA1 |
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 |