Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30623233 | 0.87 | KDM4E (0.56) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| SCHEMBL232145 | 0.87 | KDM4E (0.56) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| SCHEMBL4255360 | 0.80 | CA12 (0.51) | KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| Ethoxycarbonyl Group SCHEMBL27570410 | 0.78 | CYP2A6 (0.49) | KDM4EALDH1A1LMNANPSR1CYP2A6 | |
| SCHEMBL108632 | 0.75 | TUBB4A (0.59) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| SCHEMBL29944244 | 0.75 | TUBB4A (0.59) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| SCHEMBL6950225 | 0.75 | KDM4E (0.63) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| SCHEMBL232469 | 0.74 | KDM4E (0.66) | KDM4EALDH1A1HPGDPOLBAPOBEC3A | |
| Ethoxycarbonyl Group SCHEMBL27487577 | 0.74 | CYP2A6 (0.42) | KDM4EALDH1A1LMNACYP3A4CYP2C19 | |
| SCHEMBL28264562 | 0.74 | CYP2A6 (0.46) | KDM4EALDH1A1HPGDPOLBAPOBEC3A |
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-109748840-A | A kind of synthetic method of 2- substituted indole derivative | 中国医学科学院药物研究所 | 2019-05-14 | — | — | CN | disclosed |