Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28824434 | 0.81 | HDAC3 (0.40) | ALDH1A1SMN1; SMN2HPGDKDM4ELMNA | |
| SCHEMBL28043608 | 0.80 | OPRM1 (0.43) | ALDH1A1SMN1; SMN2HPGDKMT2AKDM4E | |
| SCHEMBL28043371 | 0.79 | ESR1 (0.43) | ALDH1A1SMN1; SMN2KDM4EPRCPPOLB | |
| SCHEMBL2088764 | 0.75 | PRCP (0.54) | PRCPOPRM1OPRK1 | |
| SCHEMBL12233898 | 0.75 | PRCP (0.54) | PRCPOPRM1OPRK1 | |
| SCHEMBL23356586 | 0.75 | ACP3 (0.45) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL30101859 | 0.74 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL28641032 | 0.74 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL28043370 | 0.73 | HTR3A (0.41) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL29657264 | 0.73 | PRCP (0.40) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A |
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-105153029-A | Method for synthesizing isoquinoline ketone compounds | UNIV SHAANXI NORMAL | 2015-12-16 | — | — | CN | disclosed |