Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 9/20 | 0.49 |
| ▸ | GAB1 | Q13480 | 2/20 | 0.49 |
| ▸ | IRS1 | P35568 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | AKT2 | P31751 | 1/20 | 0.44 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.44 |
| ▸ | GHSR | Q92847 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15623136 | 0.95 | AKT1 (0.49) | AKT1GAB1IRS1ALDH1A1HAO1 | |
| SCHEMBL15623170 | 0.94 | AKT1 (0.52) | AKT1GAB1IRS1ALDH1A1HAO1 | |
| SCHEMBL15623137 | 0.75 | HAO1 (0.49) | ALDH1A1HAO1TRPV1 | |
| SCHEMBL15623138 | 0.73 | S1PR1 (0.60) | CA2GHSRCA12CA1CA9 | |
| SCHEMBL4476875 | 0.72 | LMNA (0.64) | AKT1GAB1IRS1ALDH1A1LMNA | |
| SCHEMBL15881011 | 0.71 | ALDH1A1 (0.51) | ALDH1A1HAO1 | |
| SCHEMBL7151939 | 0.70 | FFAR1 (0.78) | AKT1GAB1CA2KDM4EPDPK1 | |
| SCHEMBL26965400 | 0.70 | CA2 (0.64) | AKT1GAB1ALDH1A1CA2LMNA | |
| SCHEMBL14822992 | 0.69 | NPSR1 (0.51) | AKT1GAB1IRS1ALDH1A1HAO1 | |
| SCHEMBL28546119 | 0.69 | CA2 (0.58) | AKT1GAB1IRS1ALDH1A1HAO1 |
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-8680282-B2 | Cyclic inhibitors of carnitine palmitoyltransferase and treating cancer | UNIVERSITY HEALTH NETWORK (CA) | 2014-03-25 | — | — | US | disclosed |