Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | KDM4B | O94953 | 1/20 | 0.32 |
| ▸ | KDM5C | P41229 | 1/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | NNMT | P40261 | 2/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4701291 | 0.83 | NOS3 (0.43) | NOS3NOS2ALDH1A1NPC1LMNA | |
| SCHEMBL4555607 | 0.74 | NNMT (0.41) | CHEK2CTSADRD4NNMTKDM1A | |
| SCHEMBL4555606 | 0.72 | CHEK2 (0.36) | CHEK2CTSANOS3NOS2KDM4B | |
| SCHEMBL2038839 | 0.69 | GPR88 (0.42) | NOS3NOS2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL4701189 | 0.65 | NPC1 (0.47) | HSD17B10NPC1LMNARAB9ASMN1; SMN2 | |
| SCHEMBL13728706 | 0.64 | AKR1C3 (0.39) | KDM5BKDM4EALDH1A1DRD4NPC1 | |
| SCHEMBL4483266 | 0.62 | KDM1A (0.39) | CHEK2KDM4BKDM5CKDM5BKDM4E | |
| SCHEMBL3797644 | 0.60 | AOC3 (0.37) | NOS3NOS2ALDH1A1HSD17B10DRD4 | |
| SCHEMBL15690982 | 0.60 | AKR1C3 (0.40) | KDM4BKDM5CKDM5BKDM4EALDH1A1 | |
| SCHEMBL2303493 | 0.60 | KAT6A (0.55) | CHEK2PARP1MYC |
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 |
|---|---|---|---|---|---|---|---|
| EP-1973890-A2 | INDANE MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-KB ACTIVITY AND USE THEREOF | Brystol-Myers Squibb Company (US) | 2008-10-01 | — | — | EP | disclosed |
| WO-2007073503-A2 | INDANE MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-KB ACTIVITY AND USE THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-06-28 | — | — | WO | disclosed |