Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.58 |
| ▸ | AHR | P35869 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | EIF4E | P06730 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 2/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30837205 | 1.00 | SCN9A (0.58) | SCN9AAHRMAPTHSD17B1SMN1; SMN2 | |
| SCHEMBL4094437 | 0.85 | HSD17B1 (0.62) | SCN9AMAPTHSD17B1SMN1; SMN2TSHR | |
| SCHEMBL8478583 | 0.83 | TSHR (0.64) | MAPTSMN1; SMN2TSHRMEN1KMT2A | |
| SCHEMBL29655535 | 0.83 | TSHR (0.64) | MAPTSMN1; SMN2TSHRMEN1KMT2A | |
| SCHEMBL313211 | 0.83 | TSHR (0.64) | MAPTSMN1; SMN2TSHRMEN1KMT2A | |
| SCHEMBL2555961 | 0.82 | XDH (0.56) | MAPTHSD17B1SMN1; SMN2EIF4EXDH | |
| SCHEMBL2560422 | 0.82 | XDH (0.56) | MAPTHSD17B1SMN1; SMN2TSHRKIF11 | |
| SCHEMBL23484544 | 0.82 | AHR (0.58) | SCN9AAHRMAPTHSD17B1TSHR | |
| SCHEMBL2637495 | 0.82 | TSHR (0.69) | SCN9AAHRTSHRCYP1B1MEN1 | |
| SCHEMBL29784149 | 0.82 | TSHR (0.69) | SCN9AAHRTSHRCYP1B1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4151302-A | Araliphatic dihalogen compounds composition and method of use | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-04-24 | — | — | US | disclosed |
| US-4125612-A | N-1-(p-Biphenylalkyl)piperazines and their use as anti-inflammatory agents | SCHERING CORPORATION (US) | 1978-11-14 | — | — | US | disclosed |
| US-4057647-A | Araliphatic dihalogen compounds and process for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-11-08 | — | — | US | disclosed |