Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.65 |
| ▸ | FLT1 | P17948 | 1/20 | 0.53 |
| ▸ | FLT4 | P35916 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL7739014 | 0.90 | KDR (0.63) | KDRFLT1FLT4HDAC6PIK3CA | |
| SCHEMBL7980820 | 0.89 | KDR (0.66) | KDRFLT1FLT4PIK3CAPIK3CG | |
| SCHEMBL7979617 | 0.88 | KDR (0.55) | KDRFLT1FLT4HDAC6PIK3CA | |
| SCHEMBL7739065 | 0.85 | KDR (0.50) | KDRFLT1FLT4RAB9A | |
| SCHEMBL7983232 | 0.85 | KDR (0.57) | KDRFLT1FLT4PIK3CAPIK3CG | |
| SCHEMBL7983601 | 0.83 | KDR (0.53) | KDRFLT1FLT4ADORA3ADORA2A | |
| SCHEMBL7744663 | 0.80 | KDR (0.76) | KDRFLT1FLT4ADORA2AADORA1 | |
| SCHEMBL7744167 | 0.79 | HDAC1 (0.53) | KDRFLT1FLT4HDAC6NPC1 | |
| SCHEMBL7739016 | 0.79 | KDR (0.56) | KDRFLT1FLT4PIK3CAPIK3CG | |
| SCHEMBL7982616 | 0.79 | KDR (0.56) | KDRFLT1FLT4PIK3CAPIK3CG |
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 |