Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | HTR1B | P28222 | 2/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9174672 | 0.75 | TYR (0.42) | CYP3A4CYP2C9TSHR | |
| SCHEMBL28969468 | 0.73 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL25995192 | 0.70 | ALOX5 (0.46) | CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL35793 | 0.70 | GABRA1 (0.50) | — | |
| SCHEMBL25995220 | 0.68 | GABRA1 (0.48) | — | |
| SCHEMBL25995234 | 0.68 | GABRA1 (0.48) | — | |
| SCHEMBL25995237 | 0.68 | PTGS2 (0.47) | CYP3A4TSHRCYP2C19HTR1AHTR1B | |
| SCHEMBL25995249 | 0.68 | PTGS2 (0.47) | CYP3A4TSHRCYP2C19HTR1AHTR1B | |
| SCHEMBL6065587 | 0.68 | CYP2C19 (0.46) | CNR1CNR2CYP2C9CYP2C19HTR1A | |
| SCHEMBL25995245 | 0.68 | GABRA1 (0.48) | — |
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-115784906-A | Method for preparing triarylmethane derivative through high-selectivity Friedel-crafts arylation reaction | 江苏科技大学 | 2023-03-14 | — | — | CN | disclosed |