Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28227062 | 0.90 | PLA2G10 (0.46) | PLA2G10PLA2G2A | |
| SCHEMBL28000844 | 0.83 | MTNR1A (0.42) | TSHR | |
| SCHEMBL3048092 | 0.81 | KDM4E (0.52) | — | |
| SCHEMBL20370925 | 0.79 | TSHR (0.63) | TSHRNR1H4SRD5A2 | |
| SCHEMBL28918465 | 0.79 | PLA2G2A (0.49) | TSHRPLA2G10PLA2G2ANR1H4SRD5A2 | |
| SCHEMBL7786982 | 0.79 | ROCK2 (0.50) | PLA2G10PLA2G2A | |
| SCHEMBL9517988 | 0.78 | GPR55 (0.46) | — | |
| SCHEMBL7789995 | 0.78 | CAPN1 (0.54) | PLA2G10PLA2G2A | |
| SCHEMBL7314900 | 0.78 | PYGL (0.43) | PLA2G10PLA2G2A | |
| SCHEMBL7313788 | 0.78 | CAPN1 (0.48) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6251917-B1 | Benzamidoaldehydes and their use as cysteine protease inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-26 | — | — | US | disclosed |
| US-6103720-A | ENZYME INHIBITORS; ANTIICHEMIC AND -TUMOR AGENTS; STROKES; ALZEIMER'S DISEASE | BASF AKTIENGESELLSCHAFT (DE) | 2000-08-15 | — | — | US | disclosed |