Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.74 |
| ▸ | HPGD | P15428 | 2/20 | 0.73 |
| ▸ | TP53 | P04637 | 1/20 | 0.73 |
| ▸ | GLA | P06280 | 1/20 | 0.73 |
| ▸ | NPC1 | O15118 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.68 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | GBA1 | P04062 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CTSD | P07339 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL5750464 | 0.91 | TAAR1 (0.62) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL11356684 | 0.90 | TAAR1 (0.61) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL17554092 | 0.90 | TAAR1 (0.64) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL5188499 | 0.89 | TAAR1 (0.59) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL11684013 | 0.86 | DNMT3A (0.65) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL6267575 | 0.86 | CYP1A2 (0.65) | HPGDTP53NPC1RAB9AMAPT | |
| SCHEMBL167922 | 0.85 | NPC1 (0.63) | TAAR1HPGDTP53GLANPC1 | |
| SCHEMBL27604453 | 0.84 | HPGD (1.00) | HPGDTP53GLARAB9AMAPT | |
| SCHEMBL28568182 | 0.84 | ALDH1A1 (0.79) | KMT2AGAAALDH1A1 | |
| SCHEMBL29385160 | 0.84 | ALDH1A1 (0.79) | KMT2AGAAALDH1A1 |
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-1126836-B1 | BENZAMIDE POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2007-02-14 | — | — | EP | disclosed |
| CN-1520298-A | Pyrazolopyrimidines as therapeutic agents | �����ʩ���عɷݹ�˾ | 2004-08-11 | — | — | CN | disclosed |
| US-6194458-B1 | 1-(2-METHOXYPHENYL)-1-OXO-2-AZA-(S)-4-I-BUTYL-4-PHENYLBUTANE, FOR EXAMPLE; TREATING VARIOUS CONDITIONS INCLUDING TRANSPLANTATION REJECTION OF ORGANS OR TISSUES IN A PATIENT; IMMUNOSUPPRESSANT COMPOSITIONS | MERCK & CO., INC. | 2001-02-27 | — | — | US | disclosed |