Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Coumarin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 11/20 | 0.95 |
| ▸ | CA9 | Q16790 | 11/20 | 0.95 |
| ▸ | CA1 | P00915 | 7/20 | 0.95 |
| ▸ | CA3 | P07451 | 7/20 | 0.95 |
| ▸ | CA4 | P22748 | 7/20 | 0.95 |
| ▸ | CA7 | P43166 | 7/20 | 0.95 |
| ▸ | CA14 | Q9ULX7 | 7/20 | 0.95 |
| ▸ | CA5A | P35218 | 6/20 | 0.95 |
| ▸ | CA6 | P23280 | 6/20 | 0.95 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.95 |
| ▸ | CA2 | P00918 | 5/20 | 0.95 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.95 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.95 |
| ▸ | LMNA | P02545 | 3/20 | 0.95 |
| ▸ | SOST | Q9BQB4 | 1/20 | 0.95 |
| ▸ | PGR | P06401 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Coumarin SCHEMBL6252 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL1038138 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL28886137 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL3441294 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL621751 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL29385611 | 0.98 | CA12 (1.00) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL6920202 | 0.95 | CA12 (0.95) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL453897 | 0.95 | CA12 (0.95) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL4958503 | 0.95 | CA12 (0.95) | CA12CA9CA1CA3CA4 | |
| Coumarin SCHEMBL22721260 | 0.95 | CA12 (0.95) | CA12CA9CA1CA3CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110862367-A | Coumarin aryl ether compound and preparation method and application thereof | 上海兆维科技发展有限公司 | 2020-03-06 | — | — | CN | claimed |
| CN-110862367-A | Coumarin aryl ether compound and preparation method and application thereof | 上海兆维科技发展有限公司 | 2020-03-06 | — | — | CN | disclosed |
| EP-1363916-A4 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | UNIV PENNSYLVANIA (US) | 2006-06-28 | — | — | EP | disclosed |
| EP-1363916-A2 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | The Trustees of The University of Pennsylvania (US) | 2003-11-26 | — | — | EP | disclosed |
| WO-2002104072-A2 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2002-12-27 | — | — | WO | disclosed |