Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29159444 | 1.00 | TAAR1 (0.43) | TAAR1IDO1CTBP2ACHEGAA | |
| SCHEMBL29159464 | 0.81 | MIF (0.49) | TAAR1IDO1ATMMAOBP2RX7 | |
| SCHEMBL30799298 | 0.81 | MIF (0.49) | TAAR1IDO1ATMMAOBP2RX7 | |
| SCHEMBL8545241 | 0.79 | MAPT (0.41) | TAAR1GAANPC1MAOB | |
| SCHEMBL14034153 | 0.79 | MAPT (0.41) | TAAR1GAANPC1MAOB | |
| SCHEMBL15944879 | 0.79 | MAPT (0.41) | TAAR1GAANPC1MAOB | |
| SCHEMBL29159457 | 0.78 | TAAR1 (0.47) | TAAR1IDO1CTBP2MAOB | |
| SCHEMBL30799587 | 0.78 | TAAR1 (0.47) | TAAR1IDO1CTBP2MAOB | |
| SCHEMBL9737107 | 0.76 | TAAR1 (0.56) | TAAR1IDO1CTBP2ACHEHRH3 | |
| SCHEMBL17217545 | 0.76 | IDO1 (0.51) | TAAR1IDO1CTBP2MAOBMAOA |
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-117603248-A | Alkynyl-containing aromatic amine compound and preparation method thereof | 西南医科大学 | 2024-02-27 | — | — | CN | disclosed |