Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4719399 | 0.70 | NOTUM (0.40) | PTGS2NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL2739329 | 0.69 | PTGS2 (0.46) | CDK2CCNE1PTGS2NPC1TP53 | |
| SCHEMBL12869756 | 0.69 | PTGS2 (0.49) | CDK2CCNE1PTGS2NPC1RAB9A | |
| SCHEMBL1040912 | 0.68 | KCNH2 (0.37) | NPC1TP53TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL7929388 | 0.67 | NPC1 (0.60) | NPC1TP53TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL2972168 | 0.67 | — | — | |
| SCHEMBL13323141 | 0.66 | PTGS2 (0.44) | CDK2CCNE1PTGS2NPC1RAB9A | |
| SCHEMBL10882067 | 0.66 | PTGS2 (0.46) | CDK2CCNE1PTGS2NPC1RAB9A | |
| SCHEMBL13354695 | 0.66 | PTGS2 (0.46) | CDK2CCNE1PTGS2NPC1RAB9A | |
| SCHEMBL4022996 | 0.65 | KMT2A (0.51) | CDK2CCNE1PTGS2NPC1RAB9A |
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-0759899-B1 | NITRO COMPOUNDS AND THEIR COMPOSITIONS HAVING ANTI-INFLAMMATORY, ANALGESIC AND ANTI-THROMBOTIC ACITIVITIES | NICOX SA (FR) | 1999-09-15 | — | — | EP | claimed |
| US-4778799-A | ANALGESIC, ANTIPYRETIC, ANTIINFLAMMATORY AGENT | TIBES ULRICH (DE) | 1988-10-18 | — | — | US | disclosed |