Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1752970 | 0.79 | TRPV1 (0.48) | SMN1; SMN2TRPV1KDM4ETSHRLMNA | |
| SCHEMBL3084564 | 0.77 | HPGD (0.47) | SMN1; SMN2HPGDKDM4ETSHRLMNA | |
| SCHEMBL27307169 | 0.76 | TRPV1 (0.46) | SMN1; SMN2TRPV1TSHRLMNAMAPK1 | |
| SCHEMBL3541707 | 0.76 | TRPV1 (0.62) | SMN1; SMN2TRPV1TSHRLMNAMEN1 | |
| SCHEMBL14943108 | 0.74 | HPGD (0.40) | SMN1; SMN2HPGDKDM4ETSHRLMNA | |
| SCHEMBL2614921 | 0.73 | CYP1A2 (0.56) | SMN1; SMN2HPGDTRPV1KDM4ETSHR | |
| SCHEMBL3083678 | 0.72 | CYP1A2 (0.62) | SMN1; SMN2HPGDKDM4ELMNAMAPK1 | |
| SCHEMBL26845639 | 0.71 | KDM4E (0.49) | SMN1; SMN2HPGDKDM4ETSHRLMNA | |
| SCHEMBL18228586 | 0.71 | HSD11B1 (0.55) | SMN1; SMN2TRPV1KDM4ETSHRMAPK1 | |
| SCHEMBL11962834 | 0.71 | HSD11B1 (0.55) | SMN1; SMN2TRPV1KDM4ETSHRMAPK1 |
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-5637708-A | Structure based design of capsid stabilizing or antiviral agents | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1997-06-10 | — | — | US | disclosed |