Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.38 |
| ▸ | WNT3 | P56703 | 1/20 | 0.38 |
| ▸ | SFRP1 | Q8N474 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL11376963 | 0.90 | TBXAS1 (0.41) | MEN1KMT2AHTTLMNATBXAS1 | |
| SCHEMBL11372413 | 0.89 | NOS1 (0.41) | MEN1KMT2ALMNAKDM4ETBXAS1 | |
| SCHEMBL11371224 | 0.87 | NR1I3 (0.46) | NR1I3ALDH1A1HMOX2CYP19A1 | |
| SCHEMBL11384247 | 0.85 | NR1I3 (0.42) | NR1I3HMOX2CYP19A1 | |
| SCHEMBL11372576 | 0.83 | NR1I3 (0.45) | NR1I3HMOX2CYP19A1 | |
| SCHEMBL11153341 | 0.80 | NPSR1 (0.63) | NPSR1HPGDGAAMEN1KMT2A | |
| SCHEMBL11375270 | 0.79 | TP53 (0.44) | NR1I3TACR1NPSR1HPGDGAA | |
| SCHEMBL11386050 | 0.78 | NR1I3 (0.44) | NR1I3NPSR1GAAKDM4EALDH1A1 | |
| SCHEMBL11377610 | 0.77 | ACHE (0.39) | ALDH1A1TBXAS1CYP19A1 | |
| SCHEMBL11373650 | 0.76 | EGLN3 (0.46) | TBXAS1CYP19A1 |
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-4289768-A | HYPOTENSIVE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-09-15 | — | — | US | disclosed |