Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 7/20 | 0.34 |
| ▸ | CA1 | P00915 | 5/20 | 0.34 |
| ▸ | CA12 | O43570 | 4/20 | 0.34 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA3 | P07451 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | CA6 | P23280 | 2/20 | 0.34 |
| ▸ | CA5A | P35218 | 2/20 | 0.34 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5310504 | 0.86 | NPC1 (0.37) | NPC1RAB9ACA2CA1CA12 | |
| SCHEMBL14513391 | 0.73 | CA1 (0.38) | NPC1RAB9ACA2CA1CA12 | |
| Hydrochloric Acid SCHEMBL5360907 | 0.73 | CA1 (0.37) | NPC1RAB9ACA2CA1CA12 | |
| SCHEMBL5577163 | 0.72 | CA1 (0.37) | NPC1RAB9ACA2CA1CA12 | |
| SCHEMBL14513390 | 0.71 | SLC2A1 (0.46) | CA2CA1CA12CA14CA9 | |
| SCHEMBL5576878 | 0.71 | CA12 (0.35) | NPC1RAB9ACA2CA1CA12 | |
| SCHEMBL5981762 | 0.71 | NPC1 (0.41) | NPC1RAB9ACA2CA1CA7 | |
| Hydrochloric Acid SCHEMBL5330503 | 0.71 | SLC2A1 (0.46) | CA2CA1CA12CA14CA9 | |
| SCHEMBL5311322 | 0.71 | NLRP3 (0.34) | NPC1CA2NLRP3TTRKMT2A | |
| SCHEMBL5329435 | 0.70 | P2RX4 (0.35) | NPC1RAB9ACA2CA1CA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007052831-A1 | PREVENTIVES/REMEDIES FOR URINARY DISTURBANCE | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-05-10 | — | — | WO | disclosed |