Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL369905 | 0.82 | MIF (0.44) | NPC1RAB9AAPPGRM1GRM5 | |
| SCHEMBL2113115 | 0.80 | NPC1 (0.51) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL9372775 | 0.78 | CYP2A6 (0.53) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL369819 | 0.74 | KMT2A (0.41) | NPC1RAB9AGRM1KMT2AALDH1A1 | |
| SCHEMBL9521880 | 0.71 | CCNC (0.58) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL2120910 | 0.71 | NPC1 (0.52) | NPC1RAB9AGRM5KMT2AALDH1A1 | |
| SCHEMBL30254457 | 0.71 | NPC1 (0.52) | NPC1RAB9AGRM5KMT2AALDH1A1 | |
| SCHEMBL18377714 | 0.71 | CYP2A6 (0.51) | GRM1GRM5ALDH1A1GAAMIF | |
| SCHEMBL12571597 | 0.70 | CA12 (0.55) | GRM1GRM5ALDH1A1MIFKDM4E | |
| SCHEMBL12369722 | 0.70 | DPP4 (0.52) | ELANEMIFPTGS1PTGS2L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2593447-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | Bayer Intellectual Property GmbH (DE) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007500-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2012-01-19 | — | — | WO | disclosed |