Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28645332 | 0.91 | LMNA (0.41) | KMT2AMAPK1MAPTTHRBKDM4E | |
| SCHEMBL28651754 | 0.80 | KMT2A (0.49) | KMT2AMAPTGAAKDM4EALOX15 | |
| SCHEMBL28633462 | 0.78 | KMT2A (0.53) | KMT2AMAPTALOX15TDP1MEN1 | |
| SCHEMBL28645763 | 0.77 | KMT2A (0.41) | KMT2AALOX15TSHRHSD17B10MEN1 | |
| SCHEMBL28652352 | 0.76 | KMT2A (0.48) | KMT2AKDM4EALDH1A1ALOX15TSHR | |
| SCHEMBL28644854 | 0.76 | KMT2A (0.48) | KMT2AMAPTKDM4EALDH1A1TSHR | |
| SCHEMBL30604559 | 0.76 | KMT2A (0.48) | KMT2AMAPTKDM4EALDH1A1TSHR | |
| SCHEMBL28652153 | 0.73 | KMT2A (0.53) | KMT2AKDM4EMEN1TP53LMNA | |
| SCHEMBL28645344 | 0.73 | KMT2A (0.41) | KMT2AKDM4EALOX15TSHRHSD17B10 | |
| SCHEMBL6288893 | 0.73 | TP53 (0.53) | KMT2AMAPTTHRBGAAMEN1 |
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-113493438-A | Tetrahydroisoquinoline compounds | 江苏先声药业有限公司 | 2021-10-12 | — | — | CN | disclosed |