Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.48 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | LNPEP | Q9UIQ6 | 4/20 | 0.45 |
| ▸ | MYC | P01106 | 1/20 | 0.45 |
| ▸ | MAX | P61244 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.43 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | ERAP2 | Q6P179 | 3/20 | 0.42 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.42 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8408864 | 0.84 | ACE (0.64) | ACELNPEPMAPTGPR132MBTPS1 | |
| SCHEMBL4068298 | 0.77 | LNPEP (0.53) | LNPEPERAP2ERAP1ALDH1A1 | |
| SCHEMBL8412258 | 0.77 | GAA (0.58) | ACELNPEPGPR132ERAP2ALDH1A1 | |
| SCHEMBL7511099 | 0.76 | ACE (0.64) | ITGA4ITGB7ACELNPEPMAPT | |
| SCHEMBL7553966 | 0.76 | GPR132 (0.58) | ACELNPEPGPR132ERAP2ERAP1 | |
| SCHEMBL7703848 | 0.75 | GPR132 (0.63) | ACELNPEPGPR132ERAP2TACR1 | |
| SCHEMBL3598219 | 0.75 | GSTP1 (0.55) | MAPTMEN1KMT2AALDH1A1CTSL | |
| SCHEMBL3597228 | 0.75 | GSTP1 (0.55) | MAPTMEN1KMT2AALDH1A1CTSL | |
| SCHEMBL8408968 | 0.75 | GPR132 (0.65) | ACEGPR132ITGB3ITGA2B | |
| SCHEMBL25471896 | 0.74 | TYR (0.52) | MEN1KMT2ATACR1CTSL |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002026697-A2 | AROMATIC DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES | PHARMACOR, INC. (CA) | 2002-04-04 | — | — | WO | disclosed |