Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553599 | 0.88 | KDR (0.48) | KDRACHEALDH1A1MAPTGAA | |
| SCHEMBL8554568 | 0.87 | KDR (0.58) | KDRALDH1A1MAPTGAALMNA | |
| SCHEMBL8414147 | 0.87 | SLC29A1 (0.43) | KDRACHEBACE1DYRK1ALMNA | |
| Hydrochloric Acid SCHEMBL8595835 | 0.86 | SLC29A1 (0.43) | KDRACHEBACE1DYRK1AALDH1A1 | |
| SCHEMBL8553993 | 0.80 | KDR (0.54) | KDRALDH1A1LMNASMN1; SMN2NPC1 | |
| SCHEMBL8555039 | 0.80 | ATM (0.62) | KDRACHEBACE1ALDH1A1MAPT | |
| SCHEMBL8552887 | 0.80 | NR4A2 (0.47) | KDRALDH1A1LMNANR4A2NR4A1 | |
| SCHEMBL8557836 | 0.79 | SLC29A1 (0.43) | KDRALDH1A1MAPTGAALMNA | |
| SCHEMBL8554363 | 0.77 | KDR (0.57) | KDRLMNAHTTNR4A2KDM4E | |
| SCHEMBL8556969 | 0.76 | REV1 (0.53) | KDRACHEBACE1ALDH1A1MAPT |
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-0582164-B1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | BRISTOL MYERS SQUIBB CO (US) | 1998-12-23 | — | — | EP | claimed |
| EP-0582164-A1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | Bristol-Myers Squibb Company (US) | 1994-02-09 | — | — | EP | claimed |