Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | HTR1D | P28221 | 3/20 | 0.38 |
| ▸ | HTR1B | P28222 | 3/20 | 0.38 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2140588 | 0.78 | BACE1 (0.37) | BACE1ALDH1A1 | |
| SCHEMBL4563494 | 0.78 | GRM2 (0.35) | RAB9ASMN1; SMN2TP53ALDH1A1NPC1 | |
| SCHEMBL1692224 | 0.76 | CRHBP (0.41) | ROCK1ROCK2HTR1AHTR1DHTR1B | |
| SCHEMBL840465 | 0.75 | GABRA1 (0.45) | ALOX15BACE1MAPTKDM4E | |
| SCHEMBL2852051 | 0.75 | CYP1A2 (0.48) | — | |
| SCHEMBL5341608 | 0.75 | MRGPRX4 (0.52) | RAB9ASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL2799679 | 0.75 | F2 (0.38) | F2RL3BACE1L3MBTL1 | |
| SCHEMBL28505033 | 0.75 | SIRT2 (0.50) | RAB9ASMN1; SMN2HSD17B10ALDH1A1NPC1 | |
| SCHEMBL501378 | 0.74 | MRGPRX4 (0.41) | BACE1PDK2 | |
| SCHEMBL14491916 | 0.74 | SIGMAR1 (0.55) | SIGMAR1 |
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-108026067-B | 6-amino-quinoline-3-carbonitriles as COT modulators | 吉利德科学公司 | 2021-01-12 | — | — | CN | disclosed |