Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28432337 | 0.92 | CYP3A4 (0.41) | KMT2AALDH1A1KDM4EHPGDHTT | |
| SCHEMBL28897158 | 0.92 | KMT2A (0.48) | KMT2AALDH1A1KDM4EHPGDMEN1 | |
| SCHEMBL28443099 | 0.91 | CA12 (0.42) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28434416 | 0.90 | CA12 (0.45) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28442068 | 0.90 | CA12 (0.45) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28443111 | 0.90 | CA12 (0.45) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28431797 | 0.90 | CA12 (0.45) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28443691 | 0.89 | CA12 (0.40) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28443692 | 0.89 | CA12 (0.40) | CA12CA9KMT2AALDH1A1KDM4E | |
| SCHEMBL28437141 | 0.89 | CA12 (0.40) | CA12CA9KMT2AALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111386261-A | Coumarin derivatives, preparation method thereof and application thereof in cancer treatment | 利德发现中心有限责任公司 | 2020-07-07 | — | — | CN | claimed |
| CN-111386261-A | Coumarin derivatives, preparation method thereof and application thereof in cancer treatment | 利德发现中心有限责任公司 | 2020-07-07 | — | — | CN | disclosed |