Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1034010 | 0.89 | KDM4E (0.50) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL13187933 | 0.79 | KDM4E (0.57) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL31299554 | 0.79 | KEAP1 (0.57) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL27220456 | 0.79 | KDM4E (0.57) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL297745 | 0.77 | — | — | |
| SCHEMBL10401216 | 0.77 | ALDH1A1 (0.43) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL154374 | 0.76 | ALDH1A1 (0.46) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL5911029 | 0.76 | KEAP1 (0.58) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA | |
| SCHEMBL9117973 | 0.75 | — | — | |
| SCHEMBL8413740 | 0.75 | KDM4E (0.50) | SMN1; SMN2KDM4EKEAP1ALDH1A1GLA |
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-5980860-A | A TROPANE-BASED DERIVATIVE COMPLEXES WITH EITHER TECHNETIUM OR RHENIUM THAT ARE SPECIFIC FOR CENTRAL NERVOUS SYSTEM RECEPTORS | THE TRUSTEES OF UNIVERSITY OF PENNSYLVANIA (US) | 1999-11-09 | — | — | US | disclosed |