Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | MAOB | P27338 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | IGF1R | P08069 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | SNCA | P37840 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | VNN1 | O95497 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10567002 | 0.98 | TSHR (0.60) | MAOAMAOBTSHRHSD17B10CALM1 | |
| SCHEMBL20053881 | 0.92 | MAOB (0.65) | MAOAMAOBTSHRHSD17B10CALM1 | |
| SCHEMBL5784919 | 0.86 | MAOB (0.58) | MAOAMAOBPOLBMAPTTAAR1 | |
| SCHEMBL11470006 | 0.85 | MAPT (0.54) | MAOAMAOBTSHRHSD17B10POLB | |
| SCHEMBL7316077 | 0.85 | MAOB (0.65) | MAOAMAOBPOLBMAPTCYP19A1 | |
| SCHEMBL4254058 | 0.84 | CALM1 (0.72) | MAOBCALM1IGF1RALOX15TAAR1 | |
| 1,4-Dimethoxybenzene SCHEMBL28617696 | 0.84 | MAOB (0.61) | MAOAMAOBTSHRPOLBMAPT | |
| SCHEMBL30757515 | 0.84 | MAOB (0.61) | MAOAMAOBTSHRPOLBMAPT | |
| SCHEMBL103904 | 0.84 | MAOB (0.61) | MAOAMAOBTSHRPOLBMAPT | |
| SCHEMBL10569888 | 0.84 | TSHR (0.68) | MAOAMAOBTSHRHSD17B10CYP19A1 |
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 |