Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA7 | P43166 | 3/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA3 | P07451 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA6 | P23280 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5329435 | 0.80 | P2RX4 (0.35) | CA1CA2CA7CA13CA12 | |
| SCHEMBL5310504 | 0.73 | NPC1 (0.37) | CA1CA2CA7CA13CA12 | |
| SCHEMBL14513391 | 0.73 | CA1 (0.38) | CA1CA2CA7CA13CA12 | |
| Hydrochloric Acid SCHEMBL5360907 | 0.72 | CA1 (0.37) | CA1CA2CA7CA13CA12 | |
| SCHEMBL5577163 | 0.72 | CA1 (0.37) | CA1CA2CA7CA13CA12 | |
| SCHEMBL5576878 | 0.70 | CA12 (0.35) | CA1CA2CA7CA13CA12 | |
| SCHEMBL5328513 | 0.70 | NPC1 (0.35) | CA1CA2CA7CA13CA12 | |
| SCHEMBL5329228 | 0.69 | PKM (0.32) | NPC1RAB9APKML3MBTL1 | |
| SCHEMBL5329224 | 0.66 | SMN1; SMN2 (0.33) | NPC1RAB9ASMN1; SMN2PKMP2RX4 | |
| SCHEMBL14513390 | 0.66 | SLC2A1 (0.46) | CA1CA2CA12CA5ACA9 |
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 |