Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.52 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ACACB | O00763 | 2/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10570506 | 0.98 | TSHR (0.61) | TSHRHSD17B10ALDH1A1LMNAMEN1 | |
| SCHEMBL19043186 | 0.89 | TSHR (0.61) | TSHRHSD17B10ALDH1A1LMNAMEN1 | |
| SCHEMBL17759273 | 0.88 | TSHR (0.80) | TSHRHSD17B10ALDH1A1LMNAMEN1 | |
| SCHEMBL10568914 | 0.88 | LMNA (0.63) | HSD17B10ALDH1A1LMNAMEN1USP2 | |
| SCHEMBL10568750 | 0.87 | TSHR (0.63) | TSHRHSD17B10ALDH1A1LMNAMEN1 | |
| SCHEMBL10567859 | 0.86 | LMNA (0.62) | HSD17B10ALDH1A1LMNAMEN1USP2 | |
| SCHEMBL3276405 | 0.86 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL9470505 | 0.85 | TSHR (0.61) | TSHRHSD17B10ALDH1A1LMNAMEN1 | |
| SCHEMBL15615801 | 0.85 | TSHR (0.66) | TSHRHSD17B10ALDH1A1L3MBTL1KDM4E | |
| SCHEMBL15615809 | 0.85 | TSHR (0.66) | TSHRHSD17B10ALDH1A1L3MBTL1KDM4E |
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-4834905-A | LIQUID CRYSTAL DIELECTRICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-05-30 | — | — | US | disclosed |
| US-4627933-A | ESTERS, ETHERS, NITRICES, HALIDES, OR HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1986-12-09 | — | — | US | disclosed |
| EP-0104327-A2 | Use of cyclic derivatives as components of liquid cristals | MERCK PATENT GmbH (DE) | 1984-04-04 | — | — | EP | disclosed |