Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7318117 | 0.87 | MAPT (0.41) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7408571 | 0.87 | MAPT (0.45) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7357006 | 0.82 | MAPT (0.40) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9271695 | 0.80 | HMOX1 (0.41) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7320000 | 0.80 | CA1 (0.36) | CYP1A2CYP2D6CYP2C19LMNAKMT2A | |
| SCHEMBL7324654 | 0.79 | METAP2 (0.41) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9642305 | 0.79 | METAP2 (0.41) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7321491 | 0.78 | PPARA (0.43) | CTSLCTSSCTSKKMT2A | |
| SCHEMBL7369995 | 0.77 | CTSK (0.40) | MAPTTDP1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10522492 | 0.71 | KLK5 (0.46) | CTSLCTSSCTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0231919-B1 | N-HETEROCYCLIC ALCOHOL RENIN INHIBITORS | E.R. Squibb & Sons, Inc. (US) | 1993-01-20 | — | — | EP | disclosed |
| US-4885292-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1989-12-05 | — | — | US | disclosed |
| EP-0231919-A2 | N-Heterocyclic alcohol renin inhibitors | E.R. Squibb & Sons, Inc. (US) | 1987-08-12 | — | — | EP | disclosed |