Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.61 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 6/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.48 |
| ▸ | ABAT | P80404 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19692716 | 0.81 | PRSS1 (0.41) | TAAR1SLC6A2SLC7A5 | |
| SCHEMBL8014472 | 0.80 | TAAR1 (0.67) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL15951398 | 0.80 | TAAR1 (0.67) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL5570367 | 0.80 | TAAR1 (0.54) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL5332232 | 0.79 | TAAR1 (0.59) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL21357615 | 0.78 | TAAR1 (0.64) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL14797209 | 0.78 | LOXL2 (0.50) | TAAR1 | |
| SCHEMBL21632218 | 0.78 | TAAR1 (0.64) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL1048764 | 0.78 | TAAR1 (0.64) | TAAR1SLC6A2SLC7A5ESR1ESR2 | |
| SCHEMBL22074724 | 0.77 | TAAR1 (0.57) | TAAR1SLC6A2SLC7A5ESR1ESR2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |