Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | IDO1 | P14902 | 2/20 | 0.69 |
| ▸ | AGXT | P21549 | 2/20 | 0.69 |
| ▸ | PNMT | P11086 | 2/20 | 0.58 |
| ▸ | MAOB | P27338 | 4/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.53 |
| ▸ | HTR3B | O95264 | 2/20 | 0.53 |
| ▸ | HTR3A | P46098 | 2/20 | 0.53 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.53 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | RXRA | P19793 | 1/20 | 0.50 |
| ▸ | RXRB | P28702 | 1/20 | 0.50 |
| ▸ | RXRG | P48443 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.50 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10296002 | 0.87 | CYP3A4 (0.60) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL10866481 | 0.86 | CYP3A4 (0.69) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL1855225 | 0.84 | CYP3A4 (0.67) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL423396 | 0.83 | CYP3A4 (0.60) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL403680 | 0.82 | IDO1 (1.00) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL7040986 | 0.82 | CYP3A4 (0.64) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL13278842 | 0.82 | CYP3A4 (0.64) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL1145772 | 0.82 | CYP3A4 (0.64) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL791970 | 0.82 | CYP3A4 (0.64) | CYP3A4IDO1AGXTPNMTMAOB | |
| SCHEMBL4950985 | 0.82 | CYP3A4 (0.64) | CYP3A4IDO1AGXTPNMTMAOB |
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-111094287-A | Substituted imidazoquinolines | 生物技术公司 | 2020-05-01 | — | — | CN | disclosed |