Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL11614501 | 0.68 | CES1 (0.38) | MTNR1AMTNR1BMAPTCYP1A2CYP3A4 | |
| SCHEMBL11614313 | 0.64 | NPC1 (0.44) | MTNR1AMTNR1BCYP2C19LMNASMN1; SMN2 | |
| SCHEMBL1639804 | 0.64 | LMNA (0.47) | MTNR1AMTNR1BTDP1LMNAGPR88 | |
| SCHEMBL11611744 | 0.64 | GRN (0.43) | MAPTPOLBLMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL27629759 | 0.63 | TDP1 (0.57) | MTNR1AMTNR1BMAPTPOLBTDP1 | |
| SCHEMBL28785118 | 0.62 | ALDH1A1 (0.41) | MAPTPOLBCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8072216 | 0.62 | GPR88 (0.49) | GPR88 | |
| SCHEMBL6032899 | 0.61 | LMNA (0.60) | MAPTPOLBLMNAHTTSMN1; SMN2 | |
| Ethyl Acetate SCHEMBL4395004 | 0.61 | LMNA (0.69) | MTNR1AMTNR1BMAPTTDP1LMNA | |
| SCHEMBL3364884 | 0.60 | POLB (0.60) | MTNR1AMTNR1BMAPTPOLBTHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4117145-A | DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4113957-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-12 | — | — | US | disclosed |