Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 2/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11746840 | 0.83 | CHAT (0.43) | CHATALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL1612398 | 0.81 | TLR8 (0.50) | CHATALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL1611573 | 0.74 | MAPT (0.45) | CHATALDH1A1GRM5CYP1A2CYP2D6 | |
| SCHEMBL1610300 | 0.73 | KCNH2 (0.49) | CHATALDH1A1GRM5CYP1A2CYP2D6 | |
| SCHEMBL27481040 | 0.72 | CHAT (0.49) | CHATALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL26260435 | 0.72 | KCNH2 (0.51) | CHATALDH1A1GRM5CYP1A2CYP2D6 | |
| SCHEMBL1612035 | 0.72 | KCNH2 (0.51) | CHATALDH1A1GRM5CYP1A2CYP2D6 | |
| SCHEMBL1610598 | 0.72 | CHAT (0.38) | CHATALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL1663806 | 0.72 | ALDH1A1 (0.48) | CHATALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL1141298 | 0.71 | HPRT1 (0.52) | CHATALDH1A1CYP2A6CA1CA2 |
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-4021421-A | ENZYME INDUCING ACTIVITY | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1977-05-03 | — | — | US | disclosed |