Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.51 |
| ▸ | CA9 | Q16790 | 4/20 | 0.51 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | STS | P08842 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7800282 | 0.82 | NQO1 (0.49) | SRCMAPTSTSKDM4EALDH1A1 | |
| SCHEMBL7807887 | 0.81 | CA12 (0.54) | CA12CA9SRC | |
| SCHEMBL7800311 | 0.79 | CA9 (0.49) | CA12CA9MAPTKDM4EALDH1A1 | |
| SCHEMBL7811499 | 0.78 | CA12 (0.48) | CA12CA9KDM4EALDH1A1CTDSP1 | |
| SCHEMBL7811453 | 0.78 | HSD17B3 (0.46) | CA12CA9SRCMAPTSTS | |
| SCHEMBL7806814 | 0.76 | CA12 (0.49) | CA12CA9MAPTKDM4EALDH1A1 | |
| SCHEMBL7800299 | 0.76 | CA12 (0.47) | CA12CA9MAPTKDM4EALDH1A1 | |
| SCHEMBL7805523 | 0.72 | ESR1 (0.50) | CA12CA9SRCKDM4EALDH1A1 | |
| SCHEMBL7805506 | 0.71 | CA9 (0.45) | CA12CA9MAPTKDM4EALDH1A1 | |
| SCHEMBL7800210 | 0.71 | CA12 (0.58) | CA12CA9ALDH1A1TP53TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0861242-B1 | HETEROCYCLIC FUNGICIDES | AVENTIS CROPSCIENCE UK LTD (GB) | 2001-05-30 | — | — | EP | disclosed |
| US-6034121-A | AGRICULTURE | AGREVO UK LIMITED (GB) | 2000-03-07 | — | — | US | disclosed |
| EP-0861242-A1 | HETEROCYCLIC FUNGICIDES | AgrEvo UK Limited (GB) | 1998-09-02 | — | — | EP | disclosed |
| WO-1997013762-A1 | HETEROCYCLIC FUNGICIDES | AGREVO UK LIMITED (GB) | 1997-04-17 | — | — | WO | disclosed |