Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 5/20 | 0.63 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8059576 | 1.00 | DHODH (0.63) | DHODHTRPM8KDM4EHSD17B10GRIK1 | |
| SCHEMBL8059673 | 0.91 | GRIK1 (0.58) | DHODHTRPM8KDM4EGRIK1NPC1 | |
| SCHEMBL8059671 | 0.91 | GRIK1 (0.58) | DHODHTRPM8KDM4EGRIK1NPC1 | |
| SCHEMBL8060340 | 0.91 | DHODH (0.60) | DHODHTRPM8KDM4EHSD17B10AKR1C4 | |
| SCHEMBL8060343 | 0.91 | DHODH (0.60) | DHODHTRPM8KDM4EHSD17B10AKR1C4 | |
| SCHEMBL8059614 | 0.88 | DHODH (0.71) | DHODHTRPM8KDM4EHSD17B10AKR1C4 | |
| SCHEMBL8059610 | 0.88 | DHODH (0.71) | DHODHTRPM8KDM4EHSD17B10AKR1C4 | |
| SCHEMBL8048682 | 0.87 | DHODH (0.56) | DHODHTRPM8KDM4EHSD17B10GRIK1 | |
| SCHEMBL8061646 | 0.87 | DHODH (0.56) | DHODHTRPM8KDM4EHSD17B10AKR1C4 | |
| SCHEMBL8048678 | 0.87 | DHODH (0.56) | DHODHTRPM8KDM4EHSD17B10GRIK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127392-A | A MUSCLE RELAXANT FOR TREATMENT OF DISORDERS ASSOCIATED WITH SMOOTH MUSCLE CONTRACTION VIA POTASSIUM CHANNEL AND CHLORIDE CHANNEL MODULATION; INOTROPIC AGENT | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-10-03 | — | — | US | disclosed |
| US-6046239-A | USED IN THE TREATMENT OF DISORDERS ASSOCIATED WITH SMOOTH MUSCLE CONTRACTION, VIA POTASSIUM CHANNEL AND CHLORIDE CHANNEL MODULATION SUCH AS URINARY INCONTINENCE, ASTHMA, ANGINA, PREMATURE LABOR, CONGESTIVE HEART FAILURE | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-04-04 | — | — | US | disclosed |