Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 2/20 | 0.43 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.42 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.42 |
| ▸ | CCNC | P24863 | 2/20 | 0.42 |
| ▸ | CDK8 | P49336 | 2/20 | 0.42 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL25591508 | 0.89 | KDR (0.49) | ATRPTGER4RAB9AKDRL3MBTL1 | |
| SCHEMBL25590678 | 0.82 | MAOB (0.45) | MAOBMAOAACHENOTUMRAB9A | |
| SCHEMBL25590895 | 0.80 | CLK2 (0.44) | ATRKDRMAPT | |
| SCHEMBL25590474 | 0.77 | ATR (0.51) | ATRTHRBRAB9AKMT2AMAPT | |
| SCHEMBL25590490 | 0.76 | ATR (0.58) | ATRMAOBMAOARAB9AKMT2A | |
| SCHEMBL25593889 | 0.76 | RAB9A (0.43) | ATRTHRBRAB9AGAAKMT2A | |
| SCHEMBL25590897 | 0.75 | ALDH1A1 (0.47) | ATRRAB9AMAPTIDO1 | |
| SCHEMBL25593788 | 0.74 | ATR (0.48) | ATRRAB9AKMT2A | |
| SCHEMBL25590495 | 0.74 | RAB9A (0.55) | ATRRAB9AGAATDP1L3MBTL1 | |
| SCHEMBL25590670 | 0.73 | ABL1 (0.47) | ATRRAB9AKMT2AMAPT |
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-2023088435-A1 | PREPARATION FOR TRISUBSTITUTED PYRIDINE DERIVATIVE AND APPLICATION AS AROMATIC HYDROCARBON RECEPTOR MODULATOR | 成都奥睿药业有限公司 | 2023-05-25 | — | — | WO | disclosed |