Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.88 |
| ▸ | RAB9A | P51151 | 5/20 | 0.88 |
| ▸ | PAX8 | Q06710 | 4/20 | 0.88 |
| ▸ | JAK2 | O60674 | 2/20 | 0.88 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.63 |
| ▸ | TP53 | P04637 | 5/20 | 0.63 |
| ▸ | GPX4 | P36969 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | GLA | P06280 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28331664 | 0.95 | NPC1 (0.97) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL5993380 | 0.94 | NPC1 (1.00) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL4160577 | 0.90 | RAB9A (0.77) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL19049114 | 0.86 | NPC1 (0.67) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL24773447 | 0.85 | RAB9A (0.85) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL5146617 | 0.85 | NPC1 (0.65) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL3772286 | 0.85 | TP53 (0.83) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL5143727 | 0.85 | NPC1 (0.65) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL17056825 | 0.85 | RAB9A (0.85) | NPC1RAB9APAX8JAK2ALDH1A1 | |
| SCHEMBL2069520 | 0.83 | TP53 (0.70) | NPC1RAB9APAX8JAK2ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6733947-B2 | MAMMOGRAMS; WELL DEFINED CHARACTERISTIC CURVE AFTER RAPID DEVELOPING | AGFA-GEVAERT (BE) | 2004-05-11 | — | — | US | disclosed |
| US-20040009423-A1 | Diagnostic radiographic silver halide photographic film material | AGFA HEALTHCARE (BE) | 2004-01-15 | — | — | US | disclosed |
| EP-1378791-A1 | Diagnostic radiographic silver halide photographic film material | Agfa-Gevaert (BE) | 2004-01-07 | — | — | EP | disclosed |
| US-4567264-A | ADRENERGIC BLOCKING AGENTS | SYNTEX (U.S.A.) INC. (US) | 1986-01-28 | — | — | US | disclosed |
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |
| EP-0126449-A1 | Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry | SYNTEX (U.S.A.) INC. (US) | 1984-11-28 | — | — | EP | disclosed |