Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CNR2 | P34972 | 9/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11828050 | 0.93 | ALDH1A1 (0.56) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11831689 | 0.92 | TSHR (0.53) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11833976 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11842918 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRNPC1RAB9ATP53 | |
| SCHEMBL11836826 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11840974 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11831440 | 0.90 | ALDH1A1 (0.49) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11834403 | 0.90 | CNR2 (0.47) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11839459 | 0.90 | ALDH1A1 (0.51) | ALDH1A1TSHRCNR2NPC1RAB9A | |
| SCHEMBL11841025 | 0.90 | ALDH1A1 (0.51) | ALDH1A1TSHRCNR2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-3956307-A | FUNGICIDES | SCHERING AKTIENGESELLSCHAFT (DT) | 1976-05-11 | — | — | US | disclosed |