Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CTSD | P07339 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | STAT3 | P40763 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1694645 | 0.91 | USP2 (0.51) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL7149331 | 0.88 | TSHR (0.50) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| Bromide SCHEMBL6284643 | 0.86 | TSHR (0.49) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL3364578 | 0.82 | CTSD (0.53) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL277654 | 0.81 | HPGD (0.56) | HPGDALDH1A1KCNA3CES2CES1 | |
| SCHEMBL2339959 | 0.81 | CTSD (0.51) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL11756296 | 0.80 | HPGD (0.55) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL195988 | 0.80 | ALDH1A1 (0.55) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| SCHEMBL29519121 | 0.80 | ALDH1A1 (0.55) | HPGDALDH1A1KCNA3NPC1RAB9A | |
| Methoxymethane SCHEMBL5593577 | 0.80 | HPGD (0.55) | HPGDALDH1A1KCNA3CES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007044796-A2 | PYRIDAZINONE COMPOUNDS AS CALCILYTICS | NPS PHARMACEUTICALS, INC. (US) | 2007-04-19 | — | — | WO | disclosed |
| WO-2007044796-A2 | PYRIDAZINONE COMPOUNDS AS CALCILYTICS | NPS PHARMACEUTICALS, INC. (US) | 2007-04-19 | — | — | WO | disclosed |