Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SUCNR1 | Q9BXA5 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4823229 | 0.81 | ALDH1A1 (0.48) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL22824076 | 0.81 | CCR1 (0.55) | CYP2A6ALDH1A1KDM4ELMNAPDE10A | |
| SCHEMBL20481012 | 0.80 | SUCNR1 (0.47) | ALDH1A1SUCNR1LMNAPDE10AALOX15 | |
| SCHEMBL12895009 | 0.78 | PDE10A (0.49) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL2009161 | 0.76 | CCR1 (0.48) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL3275331 | 0.76 | KDM4E (0.50) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL7514147 | 0.76 | ALDH1A1 (0.47) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL19952703 | 0.76 | ALDH1A1 (0.47) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL24417903 | 0.75 | ALDH1A1 (0.43) | ALDH1A1SUCNR1KDM4ELMNAMEN1 | |
| SCHEMBL22104646 | 0.75 | ALDH1A1 (0.43) | ALDH1A1SUCNR1KDM4ELMNAMEN1 |
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-6232308-B1 | USEFUL FOR INHIBITING BONE RESORPTION, TREATING AND PREVENTING OSTEOPOROSIS, INHIBITING VASCULAR RESTENOSIS, DIABETIC RETINOPATHY, MACULAR DEGENERATION, AND ANGIOGENESIS | MERCK & CO., INC. | 2001-05-15 | — | — | US | disclosed |