Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.53 |
| ▸ | FLT1 | P17948 | 1/20 | 0.49 |
| ▸ | FLT4 | P35916 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7979621 | 0.91 | KDR (0.50) | KDRFLT1FLT4CCNE2CCNE1 | |
| SCHEMBL7980821 | 0.90 | KDR (0.54) | KDRFLT1FLT4CCNE2CCNE1 | |
| SCHEMBL7982616 | 0.87 | KDR (0.56) | KDRFLT1FLT4CCNE2CCNE1 | |
| SCHEMBL7983236 | 0.84 | KDR (0.54) | KDRFLT1FLT4CCNE2CCNE1 | |
| SCHEMBL7983597 | 0.83 | KDR (0.65) | KDRFLT1FLT4PIK3CAPIK3CG | |
| SCHEMBL7982851 | 0.82 | KDR (0.52) | KDRFLT1FLT4MAPK14PIK3CA | |
| SCHEMBL7986674 | 0.81 | KDR (0.45) | KDRFLT1FLT4MAPK14CCNE2 | |
| SCHEMBL7739016 | 0.80 | KDR (0.56) | KDRFLT1FLT4CCNE2CCNE1 | |
| SCHEMBL7739014 | 0.79 | KDR (0.63) | KDRFLT1FLT4PIK3CAPIK3CG | |
| SCHEMBL7980188 | 0.79 | NTRK1 (0.48) | MAPTLMNANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6228871-B1 | THIAZOLE OR OXAZOLE DERIVATIVE TYROSINE KINASE INHIBITORS; ANTICARCINOGENIC AGENTS; AUTOIMMUNE DISEASES; DIABETIC RETINOPATHY | MERCK & CO., INC. | 2001-05-08 | — | — | US | claimed |