Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2090430 | 0.79 | IDO1 (0.53) | AOC3CHRM2CNR2IDO1TAAR1 | |
| SCHEMBL3296809 | 0.78 | IDO1 (0.61) | AOC3CHRM2CNR2IDO1TAAR1 | |
| SCHEMBL6887270 | 0.77 | ABCB1 (0.44) | AOC3KDM4EPOLBALDH1A1GAA | |
| SCHEMBL27344143 | 0.75 | MPO (0.52) | AOC3CHRM2TAAR1KDM4EALDH1A1 | |
| SCHEMBL27343013 | 0.75 | AOC3 (0.57) | AOC3CHRM2IDO1TAAR1SIGMAR1 | |
| SCHEMBL16938174 | 0.74 | APP (0.41) | AOC3KDM4EALDH1A1GAAMAPT | |
| SCHEMBL27606284 | 0.74 | AOC3 (0.42) | AOC3CHRM2CNR2IDO1TAAR1 | |
| SCHEMBL22800045 | 0.73 | IDO1 (0.52) | AOC3CHRM2CNR2IDO1TAAR1 | |
| SCHEMBL2539698 | 0.72 | CA1 (0.57) | AOC3HTTALDH1A1GAAMAPT | |
| SCHEMBL9952659 | 0.72 | IDO1 (0.50) | AOC3CHRM2CNR2IDO1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6730628-B2 | TRIMERIZING AT LEAST ONE DIISOCYANATE IN THE PRESENCE OF 0.04-2% BY WEIGHT OF A TRIMERIZATION CATALYST CONTAINING A QUATERNARY OR AMINE SALT HAVING HYDROXY GROUPS | DEGUSSA AG (DE) | 2004-05-04 | — | — | US | disclosed |