Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8558093 | 0.83 | NPC1 (0.51) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL8555004 | 0.76 | ALDH1A1 (0.57) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| Trifluoroacetic Acid SCHEMBL8553848 | 0.74 | NPC1 (0.50) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL8553599 | 0.71 | KDR (0.48) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL7517455 | 0.70 | SLC29A1 (0.76) | NPC1RAB9AALDH1A1DRD4SLC29A1 | |
| Water SCHEMBL7526796 | 0.70 | SLC29A1 (0.75) | NPC1RAB9AALDH1A1DRD4SLC29A1 | |
| Water SCHEMBL9362242 | 0.70 | SLC29A1 (0.75) | NPC1RAB9AALDH1A1DRD4SLC29A1 | |
| Hydrochloric Acid SCHEMBL7810744 | 0.70 | SLC29A1 (0.75) | NPC1RAB9AALDH1A1DRD4SLC29A1 | |
| SCHEMBL7806812 | 0.70 | RAB9A (0.74) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL6811616 | 0.69 | ALDH1A1 (0.75) | NPC1RAB9AALDH1A1KDM4EMAPT |
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 3 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 | disclosed |
| US-5382584-A | Antiischemic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-01-17 | — | — | US | disclosed |
| EP-0582164-A1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | Bristol-Myers Squibb Company (US) | 1994-02-09 | — | — | EP | disclosed |