Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL455634 | 0.77 | — | — | |
| SCHEMBL21379827 | 0.72 | LMNA (0.50) | LMNAHPGDPSIP1KMT2AGRIA4 | |
| SCHEMBL28849667 | 0.72 | CA12 (0.58) | LMNAKMT2APOLBCA2CXCL8 | |
| Hydrochloric Acid SCHEMBL29143644 | 0.71 | LMNA (0.44) | LMNAHPGDPSIP1KMT2AMEN1 | |
| SCHEMBL21380000 | 0.71 | LMNA (0.41) | LMNAHPGDPSIP1KMT2AGRIA4 | |
| SCHEMBL105233 | 0.70 | TAAR1 (0.31) | — | |
| SCHEMBL38654733 | 0.67 | PSIP1 (0.50) | LMNAHPGDPSIP1KMT2AGRIA4 | |
| SCHEMBL919936 | 0.67 | TYR (0.39) | KMT2AMEN1MAPTHTTCYP3A4 | |
| SCHEMBL28028829 | 0.67 | CA2 (0.68) | KMT2AMEN1MAPTCA2CYP2C19 | |
| SCHEMBL12472252 | 0.67 | PSIP1 (0.39) | LMNAPSIP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103958472-A | Aryl-or N-heteroaryl-substituted methanesulfonamide derivatives as vanilloid receptor ligands | GRUENENTHAL GMBH | 2014-07-30 | — | — | CN | disclosed |