Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | USP5 | P45974 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11243649 | 0.84 | L3MBTL1 (0.57) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL9135914 | 0.83 | FFAR1 (0.50) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL1509248 | 0.82 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL879572 | 0.82 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL6326343 | 0.81 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL608864 | 0.81 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL10655120 | 0.81 | PTGS2 (0.50) | EPHX1LMNA | |
| SCHEMBL26503166 | 0.81 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1FKBP1ARAB9ASMN1; SMN2 | |
| SCHEMBL1713859 | 0.80 | CNR2 (0.49) | ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL1154480 | 0.79 | PLAAT3 (0.53) | ALDH1A1MEN1KMT2AKDM4EFFAR1 |
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-2024050825-A1 | COMPOUNDS AS MLKL INHIBITORS | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2024-03-14 | — | — | WO | disclosed |