Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13003000 | 0.89 | KDM4E (0.65) | TYRKDM4EALDH1A1PKMPOLB | |
| SCHEMBL1064874 | 0.80 | KMT2A (0.51) | KDM4EALDH1A1PKMHPGDSMN1; SMN2 | |
| SCHEMBL1064876 | 0.80 | KMT2A (0.51) | KDM4EALDH1A1PKMHPGDSMN1; SMN2 | |
| SCHEMBL1341952 | 0.78 | PYGL (0.73) | ALDH1A1HPGD | |
| SCHEMBL1344394 | 0.78 | PYGL (0.73) | ALDH1A1HPGD | |
| SCHEMBL2636844 | 0.77 | KDM4E (0.46) | KDM4EALDH1A1TRPV1SMN1; SMN2MAPT | |
| SCHEMBL2636843 | 0.77 | KDM4E (0.46) | KDM4EALDH1A1TRPV1SMN1; SMN2MAPT | |
| SCHEMBL18544361 | 0.76 | CA12 (0.53) | LY96KDM4EALDH1A1MAOBMAPT | |
| SCHEMBL20085745 | 0.75 | TOP2A (0.66) | — | |
| SCHEMBL18569800 | 0.75 | NFE2L2 (0.61) | TYRKDM4EALDH1A1PKMPOLB |
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-2253621-A1 | A SET OF GELDANAMYCIN DERIVATIVES AND THEIR PREPARATION METHODS | Institute Of Medicinal Biotechnology, Chinese Academy of Medical Sciences (CN) | 2010-11-24 | — | — | EP | disclosed |