Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
| ▸ | PHGDH | O43175 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.31 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4011185 | 0.83 | F2 (0.41) | ALDH1A1MGLLPHGDHTDP1 | |
| Hydrochloric Acid SCHEMBL15212474 | 0.81 | F2 (0.39) | MGLLTDP1 | |
| Hydrochloric Acid SCHEMBL21359993 | 0.81 | F2 (0.39) | MGLLTDP1 | |
| Water SCHEMBL28947683 | 0.81 | F2 (0.39) | MGLLTDP1 | |
| SCHEMBL10312994 | 0.81 | F2 (0.44) | ALDH1A1MGLLPHGDHTDP1 | |
| Hydrochloric Acid SCHEMBL3788280 | 0.81 | F2 (0.39) | MGLLTDP1 | |
| SCHEMBL1106399 | 0.78 | CYP1A2 (0.42) | HTR1AKDM4EALDH1A1KDM4CMGLL | |
| SCHEMBL20752396 | 0.78 | CYP3A4 (0.42) | ALDH1A1MGLLPHGDHCYP2C19LMNA | |
| SCHEMBL11924531 | 0.75 | HSD17B10 (0.56) | HTR1AKDM4EALDH1A1KDM4CTDP1 | |
| SCHEMBL16435177 | 0.75 | HSD17B10 (0.56) | HTR1AKDM4EALDH1A1KDM4CTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3444251-B1 | BIARYL COMPOUNDS USEFUL FOR THE TREATMENT OF HUMAN DISEASES IN ONCOLOGY, NEUROLOGY AND IMMUNOLOGY | BIOGEN MA INC (US) | 2023-06-07 | — | — | EP | disclosed |