Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 7/20 | 0.50 |
| ▸ | PRKDC | P78527 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | TLR2 | O60603 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13362398 | 0.84 | ALDH1A1 (0.59) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| 2,4,6-Trimethoxybenzaldehyde SCHEMBL34873 | 0.79 | ERN1 (0.74) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL415683 | 0.79 | ERN1 (0.57) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL439961 | 0.79 | ERN1 (0.52) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL15348507 | 0.77 | ERN1 (0.58) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| 2,4,6-Trimethoxybenzaldehyde SCHEMBL28687257 | 0.77 | ERN1 (0.71) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL3818395 | 0.77 | ERN1 (0.60) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL22291576 | 0.77 | ERN1 (0.50) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL746009 | 0.77 | ERN1 (0.50) | ERN1PRKDCALDH1A1TSHRTDP1 | |
| SCHEMBL15981125 | 0.77 | ERN1 (0.58) | ERN1PRKDCALDH1A1TSHRTDP1 |
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-2017066402-A1 | 2,4-DIHYDROXY-NICOTINAMIDES AS APJ AGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-04-20 | — | — | WO | disclosed |