Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | IL6ST | P40189 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8225610 | 0.81 | IL6ST (0.52) | ALDH1A1IL6STHTTSMN1; SMN2HPGD | |
| SCHEMBL19183081 | 0.81 | IL6ST (0.52) | ALDH1A1IL6STHTTSMN1; SMN2 | |
| SCHEMBL4775861 | 0.81 | IL6ST (0.52) | ALDH1A1IL6STHTTSMN1; SMN2 | |
| SCHEMBL4767686 | 0.81 | IL6ST (0.52) | ALDH1A1IL6STHTTSMN1; SMN2 | |
| SCHEMBL4767695 | 0.81 | IL6ST (0.52) | ALDH1A1CYP2C19IL6STHPGDTSHR | |
| SCHEMBL4770816 | 0.81 | IL6ST (0.52) | ALDH1A1CYP2C19IL6STHPGDTSHR | |
| SCHEMBL5108652 | 0.81 | HTT (0.51) | ALDH1A1CYP2C19IL6STKDM4EHTT | |
| SCHEMBL5108649 | 0.81 | HTT (0.51) | ALDH1A1CYP2C19IL6STKDM4EHTT | |
| SCHEMBL14032439 | 0.81 | HTT (0.51) | ALDH1A1CYP2C19IL6STKDM4EHTT | |
| SCHEMBL9970272 | 0.80 | IL6ST (0.66) | ALDH1A1IL6STKDM4EHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6207686-B1 | FOR THERAPY OF HYPERTENSION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-03-27 | — | — | US | disclosed |
| EP-0792265-A1 | ENDOTHELIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-09-03 | — | — | EP | disclosed |
| WO-1996015109-A1 | ENDOTHELIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-23 | — | — | WO | disclosed |