Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 2/20 | 0.56 |
| ▸ | ATM | Q13315 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LDHA | P00338 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9008162 | 0.85 | SIGMAR1 (0.48) | STAT3ATMKDM4ELDHAPOLB | |
| SCHEMBL6780998 | 0.84 | STAT3 (0.60) | STAT3ATMKDM4ELDHAPOLB | |
| SCHEMBL6774924 | 0.83 | EBP (0.50) | STAT3ABCB1 | |
| SCHEMBL9468333 | 0.79 | ATM (0.66) | STAT3ATMKDM4EPOLBCYP19A1 | |
| SCHEMBL4245548 | 0.78 | LDHA (0.57) | STAT3ATMKDM4ELDHAPOLB | |
| SCHEMBL1966403 | 0.77 | KDM4E (0.54) | STAT3ATMKDM4ECYP19A1ABCB1 | |
| SCHEMBL27817737 | 0.77 | STAT3 (0.51) | STAT3ATMKDM4ELDHAPOLB | |
| SCHEMBL178400 | 0.76 | STAT3 (0.67) | STAT3ATMKDM4EPOLBCYP19A1 | |
| SCHEMBL516206 | 0.76 | ATM (0.66) | STAT3ATMKDM4EPOLBCYP19A1 | |
| SCHEMBL30764700 | 0.76 | ATM (0.66) | STAT3ATMKDM4EPOLBCYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6818643-B1 | 3,9-DIAZABICYCLO(3.3.1)NONAN-2-ONE DERIVATIVES; PEPTIDYL-PROLYL ISOMERASE (PPIASE OR ROTAMASE) INHIBITORS; NEUROPROTECTIVE AGENTS | BRISTOL-MYERS SQUIBB COMPANY | 2004-11-16 | — | — | US | disclosed |
| WO-2001042245-A1 | NEUROTROPHIC BICYCLIC DIAMIDES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-06-14 | — | — | WO | disclosed |