Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | CPB1 | P15086 | 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 | |
|---|---|---|---|---|
| SCHEMBL26033852 | 0.95 | SIGMAR1 (0.45) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL11224710 | 0.88 | CYP1A2 (0.46) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL8743871 | 0.88 | CYP1A2 (0.46) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL21938959 | 0.85 | CYP1A2 (0.44) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL8986251 | 0.85 | NFE2L2 (0.42) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL15295202 | 0.84 | SIGMAR1 (0.46) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL24042735 | 0.80 | NFE2L2 (0.39) | SIGMAR1NFE2L2CYP1A2HPGDMCHR1 | |
| SCHEMBL11741783 | 0.80 | NFE2L2 (0.42) | SIGMAR1NFE2L2CYP1A2KDM4EMEN1 | |
| SCHEMBL28329353 | 0.80 | NFE2L2 (0.38) | SIGMAR1NFE2L2CYP1A2SMN1; SMN2 | |
| SCHEMBL8054826 | 0.79 | SPHK1 (0.41) | SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019079626-A1 | 6-(5-MEMBERED HETEROARYL)ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED, LLC (US) | 2019-04-25 | — | — | WO | disclosed |