Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 18/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16619546 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16619134 | 0.77 | RAB9A (0.47) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16618887 | 0.76 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16619297 | 0.76 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL15010536 | 0.76 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL25419709 | 0.74 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16858412 | 0.74 | ALDH1A1 (0.65) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16619576 | 0.74 | ALDH1A1 (0.64) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL30351187 | 0.74 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL16604818 | 0.73 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4TSHRHSD17B10 |
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-2015049629-A1 | IMIDAZOQUINOLINE COMPOUNDS AS BROMODOMAIN INHIBITORS | Piramal Enterprises Limited (IN) | 2015-04-09 | — | — | WO | disclosed |