Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8905588 | 0.94 | PPARG (0.35) | ALDH1A1RORCSMN1; SMN2HPGDLMNA | |
| SCHEMBL8906329 | 0.81 | CYP1A2 (0.33) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8905446 | 0.79 | AGTR1 (0.38) | — | |
| SCHEMBL8906550 | 0.76 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPK1SMN1; SMN2HPGD | |
| SCHEMBL8788798 | 0.76 | PPARG (0.54) | RORCEDNRA | |
| SCHEMBL8906397 | 0.73 | BRD9 (0.36) | ALDH1A1KDM4EMAPK1LMNAKMT2A | |
| SCHEMBL8906176 | 0.67 | AGTR1 (0.38) | ALDH1A1KDM4EMAPK1SMN1; SMN2HPGD | |
| SCHEMBL8906831 | 0.66 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPK1SMN1; SMN2HPGD | |
| SCHEMBL8790319 | 0.65 | AGTR1 (0.67) | — | |
| SCHEMBL8905159 | 0.64 | F2 (0.38) | ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5684029-A | HYPOTENSIVE AGENTS | KARL THOMAE GMBH (DE) | 1997-11-04 | — | — | US | disclosed |