Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24969735 | 0.79 | KDM4E (0.52) | ALDH1A1KDM4ETDP1MAPTTSHR | |
| SCHEMBL24970896 | 0.77 | GBA1 (0.53) | MEN1KMT2A | |
| SCHEMBL5910406 | 0.75 | HRH3 (0.58) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| SCHEMBL24970949 | 0.74 | TRPV1 (0.40) | HTR1AHRH4 | |
| SCHEMBL14259051 | 0.74 | KDM4E (0.62) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| Hydrochloric Acid SCHEMBL5141053 | 0.73 | KDM4E (0.61) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| SCHEMBL6770354 | 0.73 | ADRB1 (0.56) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| Hydrochloric Acid SCHEMBL30222843 | 0.72 | ADRB1 (0.55) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| SCHEMBL29947184 | 0.72 | KDM4E (0.67) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| SCHEMBL4485635 | 0.71 | TSHR (0.66) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 |
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-2023002011-A1 | GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-01-26 | — | — | WO | disclosed |