Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | CASP7 | P55210 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4074396 | 0.83 | ALDH1A1 (0.42) | ALDH1A1TDP1HSD17B10HPGDKDM4E | |
| SCHEMBL3364581 | 0.83 | PTPN1 (0.49) | ALDH1A1HSD17B10HPGDKDM4EMEN1 | |
| SCHEMBL3965068 | 0.81 | HSD17B10 (0.41) | ALDH1A1HSD17B10HPGDKDM4EMEN1 | |
| SCHEMBL8517508 | 0.81 | GABRA1 (0.47) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL2927430 | 0.80 | TDP1 (0.51) | ALDH1A1TDP1HSD17B10CASP1CASP7 | |
| SCHEMBL2523153 | 0.80 | KDM4E (0.55) | ALDH1A1HSD17B10HPGDKDM4ECYP3A4 | |
| SCHEMBL1982021 | 0.80 | KDM4E (0.55) | ALDH1A1HSD17B10HPGDKDM4ECYP3A4 | |
| SCHEMBL2852455 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TDP1HSD17B10CASP1CASP7 | |
| SCHEMBL10463863 | 0.78 | ALOX15 (0.39) | ALDH1A1TDP1HSD17B10CASP1HPGD | |
| SCHEMBL17774713 | 0.77 | ALDH1A1 (0.64) | ALDH1A1TDP1HSD17B10CASP1CASP7 |
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-2215050-B1 | MANUFACTURING METHOD OF 2-HYDROXY-5-PHENYLALKYLAMINOBENZOIC ACID DERIVATIVES AND THEIR SALTS | NEUROTECH PHARMACEUTICALS CO LTD (KR) | 2012-06-27 | — | — | EP | claimed |