Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9264709 | 0.86 | MAPT (0.58) | MAPTLMNANPC1CYP1A2CYP2C9 | |
| SCHEMBL10539201 | 0.78 | KMT2A (0.62) | MAPTNPC1MEN1KMT2AHTT | |
| SCHEMBL28041307 | 0.76 | GLO1 (0.62) | MAPTLMNANPC1MEN1KMT2A | |
| SCHEMBL7828363 | 0.74 | MAPT (0.62) | MAPTLMNANPC1CYP1A2CYP2C9 | |
| SCHEMBL28459461 | 0.74 | ALDH1A1 (0.58) | MAPTLMNANPC1MEN1KMT2A | |
| SCHEMBL7828360 | 0.74 | MAPT (0.62) | MAPTLMNANPC1CYP1A2CYP2C9 | |
| SCHEMBL11216772 | 0.74 | MAPT (0.62) | MAPTLMNANPC1CYP1A2CYP2C9 | |
| Methyl Benzoate SCHEMBL29102092 | 0.74 | MEN1 (0.71) | MAPTNPC1CYP1A2MEN1KMT2A | |
| SCHEMBL11229914 | 0.73 | MAPT (0.50) | MAPTLMNANPC1CYP1A2CYP2C9 | |
| SCHEMBL11229921 | 0.73 | MAPT (0.50) | MAPTLMNANPC1CYP1A2CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4038399-A | 1,4-DIHYDROPYRIDINE CARBOXYLIC ACID ESTERS USEFUL AS CORONARY VESSEL DILATORS AND ANTI-HYPERTENSIVES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-26 | — | — | US | disclosed |
| US-4031104-A | ANTIHYPERTENSIVE AGENTS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-06-21 | — | — | US | disclosed |
| US-3996234-A | CORONARY VESSEL DILATORS, HYPOTENSIVES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-07 | — | — | US | disclosed |
| US-3974275-A | 1,4-Dihydropyridine carboxylic acid esters useful as coronary vessel dilators and anti-hypertensives | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-10 | — | — | US | disclosed |