Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | HPGD | P15428 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 3/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20688009 | 0.88 | KDM4E (0.47) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21961725 | 0.86 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL20689484 | 0.85 | KDM4E (0.45) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL20689336 | 0.85 | KDM4E (0.45) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21948921 | 0.84 | TYK2 (0.48) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21961793 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21948058 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21960689 | 0.79 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL21964836 | 0.79 | CDC7 (0.49) | CCNA2CDK2KDR | |
| SCHEMBL20688889 | 0.76 | KDM4E (0.53) | KDM4EALDH1A1HPGDHSD17B10NPC1 |
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-2020081508-A1 | TYK2 INHIBITORS AND USES THEREOF | NIMBUS LAKSHMI, INC. (US) | 2020-04-23 | — | — | WO | disclosed |