Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.53 |
| ▸ | TYR | P14679 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | RAD52 | P43351 | 2/20 | 0.50 |
| ▸ | BLM | P54132 | 2/20 | 0.50 |
| ▸ | GAPDH | P04406 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.49 |
| ▸ | HTR1A | P08908 | 3/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR2B | P41595 | 2/20 | 0.49 |
| ▸ | HTR3A | P46098 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.49 |
| ▸ | HTR3B | O95264 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29465001 | 0.84 | TYR (0.74) | TAAR1TYRRECQLKMT2ATDP1 | |
| SCHEMBL632515 | 0.84 | TYR (0.74) | TAAR1TYRRECQLKMT2ATDP1 | |
| SCHEMBL14446348 | 0.84 | TYR (0.48) | TAAR1CHRNA7TYR | |
| Hydrochloric Acid SCHEMBL5355571 | 0.83 | TYR (0.46) | TAAR1CHRNA7TYRRECQLKMT2A | |
| SCHEMBL15130521 | 0.83 | TAAR1 (0.50) | TAAR1TYRRECQLKMT2ATDP1 | |
| Hydrochloric Acid SCHEMBL29065992 | 0.83 | TYR (0.71) | TAAR1TYRRECQLKMT2ATDP1 | |
| SCHEMBL2767004 | 0.83 | CHRNA7 (0.53) | TAAR1CHRNA7TYRKMT2ATDP1 | |
| SCHEMBL6576435 | 0.81 | CHRNA7 (0.56) | CHRNA7TYRKMT2ATDP1MEN1 | |
| SCHEMBL2766520 | 0.81 | CHRNA7 (0.51) | TAAR1CHRNA7TYRKMT2ATDP1 | |
| SCHEMBL27814767 | 0.81 | TYR (0.55) | CHRNA7TYRKMT2ATDP1MEN1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2074120-A1 | TROPANE COMPOUNDS | Exelixis, Inc. (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2009055077-A1 | TROPANE COMPOUNDS | EXELIXIS, INC. (US) | 2009-04-30 | — | — | WO | disclosed |
| WO-2005021472-A2 | FLUORIDATION OF ELECTRON RICH AROMATIC SYSTEMS | IC INNOVATIONS LIMITED (GB) | 2005-03-10 | — | — | WO | disclosed |
| EP-0163948-B1 | PROCESS FOR PRODUCING AN INDOLINE | IHARA CHEMICAL IND CO | 1989-08-16 | — | — | EP | disclosed |
| US-4673749-A | CYCLIZATION OF 2-HOLOGENO PHENETHYLAMINES WITH COPPER CATALYS T AND ALKALI DEHYROHALOGENATING AGENT | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1987-06-16 | — | — | US | disclosed |
| EP-0163948-A1 | Process for producing an indoline | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 1985-12-11 | — | — | EP | disclosed |
| US-4280958-A | COPPER-TYPE CATALYST USED IN CYCLIZATION OF A HALOGENOPHENETHYLAMINE IN THE PRESENCE OF AN AMINE | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1981-07-28 | — | — | US | disclosed |
| US-4159271-A | CYCLIZATION OF A 2-HALOGENOPHENETHYLAMINE | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1979-06-26 | — | — | US | disclosed |