Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 10/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 10/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL8632126 | 0.88 | TUBB4A (0.37) | ALDH1A1LMNA | |
| SCHEMBL8635339 | 0.87 | MTNR1A (0.42) | MTNR1AMTNR1BESR1ALDH1A1LMNA | |
| SCHEMBL8633117 | 0.86 | PDE4B (0.40) | ALDH1A1LMNA | |
| SCHEMBL8635203 | 0.85 | HSP90AA1 (0.35) | ESR1ALDH1A1LMNA | |
| SCHEMBL7764803 | 0.85 | SLC9A1 (0.41) | — | |
| SCHEMBL8635349 | 0.85 | ALDH1A1 (0.39) | ALDH1A1LMNA | |
| SCHEMBL8633199 | 0.82 | PER2 (0.36) | — | |
| SCHEMBL8634165 | 0.81 | ESR1 (0.39) | NPSR1ESR1ALDH1A1 | |
| SCHEMBL8634504 | 0.80 | FLT1 (0.38) | ALDH1A1LMNACYP3A4CYP2D6ALOX15 | |
| SCHEMBL8633074 | 0.80 | CYP3A4 (0.37) | ALDH1A1LMNACYP3A4CYP2C9CYP2C19 |
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-5739142-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-14 | — | — | US | disclosed |