Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 1/20 | 0.44 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 3/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.41 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.41 |
| ▸ | CDC7 | O00311 | 2/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 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 | |
|---|---|---|---|---|
| SCHEMBL7228732 | 0.77 | RAF1 (0.57) | ALDH1A1KDM4EMEN1KMT2ARAF1 | |
| SCHEMBL4426390 | 0.77 | RAF1 (0.57) | ALDH1A1KDM4EMEN1KMT2ARAF1 | |
| SCHEMBL28964533 | 0.76 | BCHE (0.42) | ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL7445283 | 0.74 | MAPK14 (0.58) | FABP4FABP5MAPK14CSNK1DMAPK13 | |
| SCHEMBL4422522 | 0.73 | MAPK14 (0.59) | MEN1KMT2ANSD3MAPK14CSNK1D | |
| SCHEMBL5079652 | 0.73 | MAPK14 (0.59) | MEN1KMT2ANSD3MAPK14CSNK1D | |
| SCHEMBL7415940 | 0.73 | ALDH1A1 (0.56) | ALDH1A1KDM4EMEN1KMT2ANSD3 | |
| SCHEMBL8488765 | 0.72 | MAPK14 (0.55) | ALDH1A1KDM4ENSD3CNR1FABP4 | |
| SCHEMBL9961397 | 0.72 | NSD3 (0.55) | ALDH1A1KDM4EMEN1KMT2ARAF1 | |
| SCHEMBL14369862 | 0.72 | NPC1 (0.55) | ALDH1A1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1083473-A | New imidazolium compounds and pharmaceutical composition thereof | SMITHKLINE BEECHAM CORP (US) | 1994-03-09 | — | — | CN | claimed |
| US-5916891-A | CYTOKINE MEDIATED DISEASES | SMITHKLINE BEECHAM CORPORATION (US) | 1999-06-29 | — | — | US | disclosed |
| US-5686455-A | Imidazole derivatives and their use as cytokine inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1997-11-11 | — | — | US | disclosed |
| CN-1083473-A | New imidazolium compounds and pharmaceutical composition thereof | SMITHKLINE BEECHAM CORP (US) | 1994-03-09 | — | — | CN | disclosed |