Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 1.00 |
| ▸ | RAB9A | P51151 | 4/20 | 0.71 |
| ▸ | NPC1 | O15118 | 4/20 | 0.71 |
| ▸ | BCHE | P06276 | 2/20 | 0.69 |
| ▸ | AR | P10275 | 6/20 | 0.63 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 4/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512670 | 0.91 | ALDH1A1 (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL14304932 | 0.86 | BCHE (0.86) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL10766969 | 0.85 | ALDH1A1 (0.74) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL14303260 | 0.84 | BCHE (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL6141660 | 0.84 | BCHE (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL14304381 | 0.84 | BCHE (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL14303261 | 0.84 | BCHE (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL14304387 | 0.84 | BCHE (0.83) | ALDH1A1RAB9ANPC1BCHEAR | |
| SCHEMBL425175 | 0.83 | RAB9A (1.00) | ALDH1A1RAB9ANPC1BCHEAR | |
| Bromide SCHEMBL5084026 | 0.83 | BCHE (0.80) | ALDH1A1RAB9ANPC1BCHEAR |
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-0334818-B1 | Pharmacologically active alkylthiobenz imidazole derivatives and process for the preparation thereof | DOMPE FARMACEUTICI SPA (IT) | 1993-12-01 | — | — | EP | disclosed |
| US-4983620-A | ANTIHISTAMINES, ANTIALLERGENS | DOMPE FARMACEUTICI S.P.A. (IT) | 1991-01-08 | — | — | US | disclosed |
| EP-0334818-A1 | Pharmacologically active alkylthiobenz imidazole derivatives and process for the preparation thereof | DOMPE' FARMACEUTICI S.p.A. (IT) | 1989-09-27 | — | — | EP | disclosed |