Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5819303 | 0.86 | NPSR1 (0.49) | NPSR1KDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL5807546 | 0.69 | NPSR1 (0.70) | NPSR1KDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL25908740 | 0.68 | NPSR1 (0.62) | NPSR1CYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL6034953 | 0.68 | TGM2 (0.52) | CYP1A2CYP3A4CYP2C19ALDH1A1LMNA | |
| SCHEMBL19079794 | 0.68 | NPSR1 (0.68) | NPSR1KDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL3755623 | 0.65 | KDM4E (0.60) | NPSR1KDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL6033995 | 0.65 | TGM2 (0.59) | KDM4EALDH1A1LMNAHPGDRXFP1 | |
| SCHEMBL6034010 | 0.63 | TGM2 (0.75) | KDM4EALDH1A1KMT2AMEN1POLB | |
| SCHEMBL2369361 | 0.63 | ALDH1A1 (0.69) | KDM4EALDH1A1LMNAHPGDRXFP1 | |
| SCHEMBL6034224 | 0.63 | TGM2 (0.59) | NPSR1KDM4EALDH1A1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006093518-A2 | THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS | APATH, LLC (US) | 2006-09-08 | — | — | WO | disclosed |