Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 15/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.63 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19498788 | 0.82 | SIGMAR1 (1.00) | SIGMAR1OPRK1 | |
| SCHEMBL18435350 | 0.82 | SIGMAR1 (0.72) | SIGMAR1OPRK1ATMTAAR1 | |
| SCHEMBL27830403 | 0.82 | SIGMAR1 (1.00) | SIGMAR1OPRK1 | |
| SCHEMBL19498803 | 0.82 | OPRK1 (0.81) | SIGMAR1OPRK1MEN1KMT2A | |
| SCHEMBL9360922 | 0.82 | SIGMAR1 (1.00) | SIGMAR1OPRK1 | |
| SCHEMBL11023396 | 0.81 | SIGMAR1 (0.70) | SIGMAR1OPRK1ATMTAAR1 | |
| SCHEMBL13995962 | 0.81 | SIGMAR1 (0.76) | SIGMAR1OPRK1ATMTAAR1 | |
| SCHEMBL1005591 | 0.80 | SIGMAR1 (0.68) | SIGMAR1ATMTAAR1MEN1KMT2A | |
| SCHEMBL1005593 | 0.80 | SIGMAR1 (0.68) | SIGMAR1ATMTAAR1MEN1KMT2A | |
| SCHEMBL4412493 | 0.80 | SIGMAR1 (0.63) | SIGMAR1OPRK1ATMTAAR1MEN1 |
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-1730099-A4 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2008-03-12 | — | — | EP | disclosed |
| EP-1730099-A2 | MITOTIC KINESIN INHIBITORS | Merck & Co., Inc. (US) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005092011-A2 | MITOTIC KINESIN INHIBITORS | MERCK & CO., INC. (US) | 2005-10-06 | — | — | WO | disclosed |