Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28062904 | 0.90 | KDM4E (0.46) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL28062758 | 0.90 | HSD17B10 (0.43) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL28062953 | 0.88 | KDM4E (0.44) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL28206996 | 0.85 | ALDH1A1 (0.53) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL28207430 | 0.83 | KDM4E (0.53) | KDM4EKMT2AMEN1GAA | |
| SCHEMBL28062757 | 0.80 | ALDH1A1 (0.42) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL19322263 | 0.79 | GABRA1 (0.43) | KDM4EALDH1A1HSD17B10HPGDMAPK1 | |
| SCHEMBL28207446 | 0.78 | KDM4E (0.50) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL28062838 | 0.78 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10KMT2AMEN1 | |
| SCHEMBL19322277 | 0.78 | ALDH1A1 (0.60) | KDM4EALDH1A1HSD17B10KMT2AMEN1 |
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-105646327-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | 上海大学 | 2016-06-08 | — | — | CN | disclosed |