Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.44 |
| ▸ | MAOB | P27338 | 5/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ROS1 | P08922 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3742863 | 0.85 | ROS1 (0.51) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL30398896 | 0.82 | CES1 (0.62) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL4192180 | 0.82 | CES1 (0.62) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL11702086 | 0.77 | ALDH1A1 (0.47) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL11701612 | 0.77 | HPGD (0.42) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL11882947 | 0.76 | CSNK1G1 (0.51) | ALDH1A1KDM4EHSD17B10ELANECSNK1G1 | |
| SCHEMBL16601853 | 0.73 | CSNK1G1 (0.57) | MAOAMAOBALDH1A1KDM4EHSD17B10 | |
| SCHEMBL18831115 | 0.72 | CSNK1G1 (0.51) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL24403047 | 0.72 | CES1 (0.64) | MAOAMAOBCES1ALDH1A1KDM4E | |
| SCHEMBL28202262 | 0.71 | MAOA (0.61) | MAOAMAOBCES1ALDH1A1KDM4E |
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-4006161-A | SEDATIVE, TRANQUILIZER | ELI LILLY AND COMPANY (US) | 1977-02-01 | — | — | US | disclosed |