Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP5 | Q13451 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6778408 | 0.97 | FKBP5 (0.50) | FKBP5ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL6776495 | 0.90 | FKBP5 (0.51) | FKBP5KMT2AHTT | |
| SCHEMBL6775961 | 0.85 | KMT2A (0.42) | FKBP5L3MBTL1POLBKMT2A | |
| SCHEMBL6776517 | 0.84 | FKBP5 (0.45) | FKBP5ALDH1A1L3MBTL1POLBKMT2A | |
| SCHEMBL6779072 | 0.82 | FKBP5 (0.54) | FKBP5ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL6785002 | 0.82 | KMT2A (0.41) | FKBP5L3MBTL1POLBKMT2A | |
| SCHEMBL6778841 | 0.81 | KMT2A (0.41) | FKBP5L3MBTL1POLBKMT2A | |
| SCHEMBL15436137 | 0.80 | FKBP5 (0.49) | FKBP5ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL6774588 | 0.77 | FKBP5 (0.47) | FKBP5ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL6780481 | 0.76 | FKBP5 (0.55) | FKBP5KMT2A |
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 |