Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | LPO | P22079 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL29243780 | 0.98 | ALDH1A1 (0.35) | ALDH1A1KMT2APOLBCYP3A4CYP2E1 | |
| Perchlorate SCHEMBL30215899 | 0.88 | ALDH1A1 (0.35) | ALDH1A1KMT2APOLBFDPSKDM4E | |
| SCHEMBL2930973 | 0.78 | ALDH1A1 (0.38) | ALDH1A1KMT2APOLBCYP3A4CYP2E1 | |
| SCHEMBL2514772 | 0.77 | CYP2E1 (0.33) | ALDH1A1KMT2APOLBCYP3A4CYP2E1 | |
| SCHEMBL2679796 | 0.76 | ALDH1A1 (0.32) | ALDH1A1KMT2APOLBKDM4EMEN1 | |
| SCHEMBL19622429 | 0.74 | KMT2A (0.35) | ALDH1A1KMT2APOLBCYP3A4CYP2E1 | |
| SCHEMBL20518476 | 0.71 | MEN1 (0.32) | ALDH1A1KMT2ACYP3A4MEN1LMNA | |
| SCHEMBL27669839 | 0.71 | — | — | |
| SCHEMBL32670786 | 0.71 | — | — | |
| SCHEMBL22672901 | 0.71 | ALDH1A1 (0.34) | ALDH1A1KMT2APOLBFDPS |
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 |
|---|---|---|---|---|---|---|---|
| CN-102948001-B | Electrolyte material, electrolyte for lithium secondary battery, lithium secondary battery using same, and novel lithium salt | THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO.,LTD. (JP) | 2015-09-23 | — | — | CN | disclosed |