Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGG1 | O15527 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | SFN | P31947 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.47 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HTR1D | P28221 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4936220 | 0.87 | RAB9A (0.63) | OGG1ALDH1A1KDM4EMAPTRAB9A | |
| SCHEMBL9195201 | 0.81 | HTT (0.53) | ALDH1A1KDM4EMAPTSFNTSHR | |
| SCHEMBL6203335 | 0.81 | HTT (0.53) | ALDH1A1KDM4EMAPTSFNTSHR | |
| SCHEMBL692136 | 0.80 | KMT2A (0.65) | ALDH1A1KDM4EMAPTTSHRHPGD | |
| SCHEMBL9722695 | 0.80 | MRGPRX4 (0.51) | ALDH1A1KDM4EMAPTSFNRAB9A | |
| SCHEMBL8816518 | 0.79 | LMNA (0.58) | ALDH1A1KDM4EMAPTSFNTSHR | |
| SCHEMBL28219396 | 0.78 | KMT2A (0.62) | ALDH1A1KDM4EMAPTTSHRHPGD | |
| Ammonia Solution, Strong SCHEMBL27869911 | 0.78 | KMT2A (0.62) | ALDH1A1KDM4EMAPTTSHRHPGD | |
| Water SCHEMBL28856010 | 0.78 | KMT2A (0.62) | ALDH1A1KDM4EMAPTTSHRHPGD | |
| SCHEMBL5235490 | 0.78 | MRGPRX4 (0.50) | ALDH1A1KDM4EMAPTSFNTSHR |
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-104628645-B | Pyrazole-containing bishydrazide compound and preparation method and application thereof | 浙江工业大学 | 2017-01-25 | — | — | CN | disclosed |
| CN-104628645-A | Pyrazole-containing bishydrazide compound and preparation method and application thereof | UNIV ZHEJIANG TECHNOLOGY | 2015-05-20 | — | — | CN | disclosed |