Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL241354 | 0.88 | MEN1 (0.36) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL245953 | 0.88 | MEN1 (0.36) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL15182604 | 0.86 | PSIP1 (0.38) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL243290 | 0.86 | PSIP1 (0.47) | MEN1KMT2AMCHR1MAPK1POLB | |
| SCHEMBL245596 | 0.83 | PSIP1 (0.35) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL245253 | 0.83 | PSIP1 (0.35) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL245597 | 0.83 | PSIP1 (0.35) | MEN1KMT2AMCHR1MAPK1CYP1A2 | |
| SCHEMBL20021129 | 0.83 | MCHR1 (0.32) | MCHR1PSIP1 | |
| SCHEMBL20020744 | 0.82 | TLR7 (0.33) | KMT2APSIP1 | |
| SCHEMBL15182562 | 0.78 | MOK (0.44) | MCHR1KDM4EALDH1A1NPC1RAB9A |
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-2588455-B1 | 2-QUINOLINYL-ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES INC (US) | 2018-04-04 | — | — | EP | disclosed |