Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 5/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | TOP1 | P11387 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28856056 | 0.84 | PPARG (0.47) | TGFBR1RAB9AALDH1A1MAPK1CYP1A2 | |
| SCHEMBL3905856 | 0.78 | KMO (0.47) | KMORAB9AKDM4EALDH1A1MAPK1 | |
| SCHEMBL28200272 | 0.78 | HDAC1 (0.50) | TGFBR1TOP1MAPKAPK2 | |
| SCHEMBL28856181 | 0.75 | LOXL2 (0.50) | TGFBR1PPARGCNR1 | |
| SCHEMBL241795 | 0.74 | RAB9A (0.46) | RAB9AALDH1A1NPC1MAPTNFKB1 | |
| SCHEMBL28200295 | 0.74 | KDM2B (0.38) | CNR1NOTUM | |
| SCHEMBL2666352 | 0.70 | CCR1 (0.57) | KMORAB9AKDM4EALDH1A1MAPK1 | |
| SCHEMBL4120500 | 0.70 | CYP11B1 (0.46) | KMORAB9AKDM4EALDH1A1MAPK1 | |
| SCHEMBL3904494 | 0.69 | CYP11B1 (0.45) | KMORAB9AKDM4EALDH1A1MAPK1 | |
| SCHEMBL28199585 | 0.68 | KMO (0.52) | KMORAB9AKDM4EALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107709311-A | The carboxamides derivatives of 2 phenyl, 6 imidazolyl pyridines 4 and its purposes as EAAT3 inhibitor | 豪夫迈·罗氏有限公司 | 2018-02-16 | — | — | CN | disclosed |