Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR5A | P47898 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28369168 | 0.81 | MAPT (0.46) | VCPMAPTHSD17B10TP53KMT2A | |
| SCHEMBL28365570 | 0.78 | TDP1 (0.38) | VCPMAPTHSD17B10TP53KMT2A | |
| SCHEMBL6249274 | 0.78 | KMT2A (0.51) | MAPTHSD17B10KMT2AMGLLHTR1A | |
| SCHEMBL28202823 | 0.77 | ALDH1A1 (0.50) | VCPTP53KMT2APOLBALDH1A1 | |
| SCHEMBL13425051 | 0.73 | HDAC10 (0.36) | MAPTTP53KMT2AALDH1A1KDM4E | |
| SCHEMBL28369113 | 0.70 | CYP19A1 (0.52) | VCPALDH1A1PLA2G10TSHRNOTUM | |
| SCHEMBL28365057 | 0.70 | CYP19A1 (0.46) | VCPMAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL28365347 | 0.69 | NOTUM (0.40) | VCPMAPTTP53KMT2AALDH1A1 | |
| SCHEMBL28365207 | 0.69 | KDM4E (0.47) | VCPMAPTHSD17B10KMT2AALDH1A1 | |
| SCHEMBL28369134 | 0.69 | BIRC5 (0.44) | VCPMAPTPOLBLMNAALDH1A1 |
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-107619385-B | Method for synthesizing 2-trifluoromethyl indole by palladium-catalyzed aryl enamine intramolecular amine | 温州大学 | 2020-02-21 | — | — | CN | disclosed |