Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 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 | |
|---|---|---|---|---|
| SCHEMBL9648172 | 0.89 | MRGPRX4 (0.48) | ALDH1A1MRGPRX4KDM4EHPGDHSD17B10 | |
| SCHEMBL10401911 | 0.88 | CCNB2 (0.36) | ALDH1A1LMNAPLA2G2AMAP2K1KDM4E | |
| SCHEMBL9647633 | 0.88 | PDE10A (0.39) | MRGPRX4PLA2G2AKDM4EKMT2AMAPK10 | |
| Hydrochloric Acid SCHEMBL10401640 | 0.86 | PDE10A (0.38) | MRGPRX4PLA2G2AKDM4EKMT2AMAPK10 | |
| SCHEMBL10401974 | 0.86 | ALDH1A1 (0.39) | ALDH1A1LMNAPLA2G2AMAP2K1KDM4E | |
| SCHEMBL9647526 | 0.75 | PLK1 (0.38) | ALDH1A1LMNAPTK2KDM4EPOLB | |
| SCHEMBL7104778 | 0.75 | PDE10A (0.42) | ALDH1A1LMNAHPGDHSD17B10HTT | |
| SCHEMBL9645530 | 0.75 | CCNE2 (0.37) | ALDH1A1LMNAKDM4EHPGDHSD17B10 | |
| SCHEMBL28104610 | 0.75 | ALDH1A1 (0.50) | ALDH1A1LMNAKDM4EPOLBHPGD | |
| Hydrochloric Acid SCHEMBL10402047 | 0.74 | PLK1 (0.37) | ALDH1A1LMNAPTK2KDM4EPOLB |
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-4923865-A | Substituted 1-(1H-imidazol-4-yl)alkyl-benzamides as anti-ischemics and as alpha-2-adrenergic receptor agonists | U C B SOCIETE ANONYME (BE) | 1990-05-08 | — | — | US | disclosed |