Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | DHFR | P00374 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7414856 | 0.93 | NR1I2 (0.67) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL9688992 | 0.87 | GAA (0.54) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL29676206 | 0.86 | NR1I2 (0.73) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL3034560 | 0.86 | NR1I2 (0.73) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL10675417 | 0.84 | NR1I2 (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL7377705 | 0.84 | NR1I2 (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL7372591 | 0.84 | NR1I2 (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL7381344 | 0.84 | KDM4E (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL9433749 | 0.83 | KDM4E (0.47) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 | |
| SCHEMBL7380940 | 0.83 | NR1I2 (0.55) | MAPTSMN1; SMN2KDM4EALDH1A1NR1I2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114516774-A | Preparation method of chiral bromo-1, 4-dihydropyridine compound | 中国科学院成都生物研究所 | 2022-05-20 | — | — | CN | disclosed |
| US-5064839-A | Vasodilators, coronary disorders, hypotensive | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1991-11-12 | — | — | US | disclosed |
| US-4567268-A | Process for preparation of certain tetrahydrofuro[3,4-b]pyridines | MERCK & CO., INC. (US) | 1986-01-28 | — | — | US | disclosed |