Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 6/20 | 0.47 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6779125 | 0.93 | FKBP1A (0.44) | FKBP1AFKBP5KMT2A | |
| SCHEMBL6774588 | 0.91 | FKBP5 (0.47) | FKBP1AFKBP5ALDH1A1KMT2A | |
| SCHEMBL6781032 | 0.89 | FKBP1A (0.47) | FKBP1AFKBP5ALDH1A1KMT2A | |
| SCHEMBL6783532 | 0.88 | FKBP5 (0.47) | FKBP1AFKBP5ALDH1A1KMT2AMAPT | |
| SCHEMBL6779072 | 0.86 | FKBP5 (0.54) | FKBP1AFKBP5ALDH1A1KMT2A | |
| SCHEMBL6784892 | 0.86 | FKBP1A (0.48) | FKBP1AFKBP5ALDH1A1 | |
| SCHEMBL6785000 | 0.85 | FKBP1A (0.45) | FKBP1AFKBP5ALDH1A1KMT2AMAPT | |
| SCHEMBL6779579 | 0.77 | BCHE (0.42) | FKBP1AALDH1A1KMT2AOPRM1MAPT | |
| SCHEMBL6785090 | 0.75 | FKBP1A (0.50) | FKBP1AFKBP5KMT2A | |
| SCHEMBL6776495 | 0.73 | FKBP5 (0.51) | FKBP1AFKBP5KMT2A |
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-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 |