Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.47 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20420764 | 0.83 | AR (0.57) | ALDH1A1HPGDKDM4EHSD17B10KCNA3 | |
| SCHEMBL20420716 | 0.83 | ALDH1A1 (0.52) | ALDH1A1HPGDKDM4EHSD17B10TDP1 | |
| SCHEMBL30227920 | 0.80 | KCNA3 (0.53) | ALDH1A1HPGDKDM4EHSD17B10TDP1 | |
| SCHEMBL30228520 | 0.74 | CA12 (0.65) | ALDH1A1HPGDKDM4EHSD17B10KCNA3 | |
| SCHEMBL27657088 | 0.72 | KCNA3 (0.59) | ALDH1A1HPGDKDM4EHSD17B10TDP1 | |
| SCHEMBL30228288 | 0.71 | KDM4E (0.47) | KDM4EMEN1KMT2AARHSD17B3 | |
| SCHEMBL20420775 | 0.69 | PTGES (0.53) | ALDH1A1HPGDKDM4EHSD17B10CYP3A4 | |
| SCHEMBL30231424 | 0.69 | KCNA3 (0.53) | ALDH1A1HPGDKDM4ETDP1KCNA3 | |
| SCHEMBL6827384 | 0.68 | ALDH1A1 (0.60) | ALDH1A1HPGDKDM4EHSD17B10TDP1 | |
| SCHEMBL20428335 | 0.68 | APP (0.52) | ALDH1A1HPGDKDM4EHSD17B10KCNA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3354648-A1 | 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF | Guizhou Bailing Group Pharmaceutical Co., Ltd. (CN) | 2018-08-01 | — | — | EP | disclosed |