Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | ALB | P02768 | 1/20 | 0.34 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.34 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7469836 | 0.90 | MAOB (0.41) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL5868993 | 0.87 | CYP17A1 (0.40) | ALOX5APFEN1TP53 | |
| SCHEMBL5868818 | 0.78 | CYP17A1 (0.41) | ALOX5APFEN1MAPT | |
| SCHEMBL6609589 | 0.77 | MAPT (0.38) | MEN1KMT2AALDH1A1HPGDPOLB | |
| SCHEMBL7464541 | 0.77 | BCHE (0.36) | MEN1KMT2AALDH1A1MYCMAPT | |
| SCHEMBL5868769 | 0.77 | CYP17A1 (0.45) | HDAC2MYCMAOB | |
| SCHEMBL7455415 | 0.76 | RAF1 (0.36) | ALDH1A1RAB9A | |
| SCHEMBL7527939 | 0.76 | RAB9A (0.38) | MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL7465211 | 0.76 | GSK3B (0.40) | CYP3A4CYP2C9KDM4EALDH1A1RAB9A | |
| SCHEMBL7704536 | 0.72 | DHODH (0.36) | MEN1KMT2AALDH1A1MAPTRAB9A |
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-6509328-B1 | Metabotropic glutamate receptor antagonists and accordingly are useful for the treatment of a range of neurological disorders, including psychosis, schizophrenia, Alzheimer's and others | HOFFMANN-LA ROCHE INC. | 2003-01-21 | — | — | US | disclosed |