Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5794655 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 | |
| SCHEMBL10441731 | 0.73 | ALDH1A1 (0.51) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 | |
| SCHEMBL701485 | 0.73 | ALDH1A1 (0.41) | ALDH1A1KIF11CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8175237 | 0.72 | ALDH1A1 (0.50) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 | |
| SCHEMBL7956195 | 0.72 | CRHBP (0.52) | ALDH1A1CRHBPCRHR2KDM4EGAA | |
| SCHEMBL11384727 | 0.71 | CYP3A4 (0.41) | ALDH1A1KDM4EGAACYP3A4CYP1A2 | |
| SCHEMBL28643060 | 0.71 | ALDH1A1 (0.46) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 | |
| SCHEMBL15239119 | 0.71 | KIF11 (0.44) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 | |
| SCHEMBL7900944 | 0.71 | CYP2C9 (0.47) | ALDH1A1KDM4EHPGDMAPTNPC1 | |
| SCHEMBL19265029 | 0.70 | HPGD (0.43) | ALDH1A1MAPK1KIF11CYP3A4CYP1A2 |
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-3609869-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | Bayer Aktiengesellschaft (DE) | 2020-02-19 | — | — | EP | disclosed |
| WO-2018189011-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | BAYER AKTIENGESELLSCHAFT (DE) | 2018-10-18 | — | — | WO | disclosed |