Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.63 |
| ▸ | SCD | O00767 | 1/20 | 0.59 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TGM2 | P21980 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27854173 | 0.86 | SCD (0.61) | CA5ASCDGRM2ALDH1A1TGM2 | |
| SCHEMBL15964859 | 0.85 | SCD (0.59) | CA5ASCDPTGS2ALDH1A1TGM2 | |
| SCHEMBL9857993 | 0.84 | ALDH1A1 (0.63) | CA5ASCDPTGS2ALDH1A1TGM2 | |
| SCHEMBL15964868 | 0.83 | CA5A (0.65) | CA5ASCDGRM2ALDH1A1LMNA | |
| SCHEMBL16554654 | 0.82 | SCD (0.57) | CA5ASCDPTGS2ALDH1A1TGM2 | |
| SCHEMBL9858313 | 0.80 | CA5A (0.61) | CA5ASCDGRM2USP2ALDH1A1 | |
| SCHEMBL9857419 | 0.80 | CA5A (0.61) | CA5ASCDGRM2USP2ALDH1A1 | |
| SCHEMBL1974270 | 0.78 | SCD (0.66) | CA5ASCDGRM2ALDH1A1TGM2 | |
| Rufinamide SCHEMBL230448 | 0.78 | CA5A (1.00) | CA5ASCDGRM2ALDH1A1TGM2 | |
| Rufinamide SCHEMBL20769779 | 0.78 | CA5A (1.00) | CA5ASCDGRM2ALDH1A1TGM2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101918376-A | 1,2, 3-triazole derivatives useful as inhibitors of stearoyl-coa desaturase | SMITHKLINE BEECHAM CORP | 2010-12-15 | — | — | CN | claimed |
| EP-3508484-A1 | HETEROCYCLIC AMIDES AS KINASE INHIBITORS | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2019-07-10 | — | — | EP | disclosed |
| EP-3342771-A1 | HETEROCYCLIC AMIDES AS KINASE INHIBITORS | GlaxoSmithKline Intellectual Property Development Ltd (GB) | 2018-07-04 | — | — | EP | disclosed |
| CN-101918376-B | 1,2, 3-triazole derivatives useful as inhibitors of stearoyl-coa desaturase | SMITHKLINE BEECHAM CORP | 2013-11-06 | — | — | CN | disclosed |
| CN-101918376-A | 1,2, 3-triazole derivatives useful as inhibitors of stearoyl-coa desaturase | SMITHKLINE BEECHAM CORP | 2010-12-15 | — | — | CN | disclosed |