Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MDM4 | O15151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415253 | 0.84 | PIN1 (0.42) | SMN1; SMN2PIN1MMP8POLBMAPT | |
| SCHEMBL7266768 | 0.83 | PIN1 (0.41) | SMN1; SMN2PIN1MMP8GAAPOLB | |
| SCHEMBL7267997 | 0.80 | MMP8 (0.34) | MMP8MAPT | |
| SCHEMBL6784316 | 0.74 | SMN1; SMN2 (0.43) | SMN1; SMN2PIN1MMP8POLBALDH1A1 | |
| SCHEMBL1932712 | 0.73 | MMP8 (0.36) | SMN1; SMN2MMP8LMNAHSD17B10ALDH1A1 | |
| SCHEMBL11318849 | 0.72 | MMP8 (0.32) | MMP8ALDH1A1TSHR | |
| SCHEMBL3889930 | 0.72 | MMP8 (0.37) | SMN1; SMN2PIN1MMP8GAALMNA | |
| SCHEMBL2047572 | 0.70 | SMN1; SMN2 (0.44) | SMN1; SMN2PIN1MMP8POLBMAPT | |
| SCHEMBL7274362 | 0.70 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL11595501 | 0.69 | CYP2D6 (0.36) | SMN1; SMN2MMP8ALDH1A1TSHR |
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 |