Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | ABCC9 | O60706 | 8/20 | 0.46 |
| ▸ | ABCC8 | Q09428 | 8/20 | 0.46 |
| ▸ | KCNJ11 | Q14654 | 8/20 | 0.46 |
| ▸ | KCNJ8 | Q15842 | 8/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 5/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7096707 | 0.92 | ALDH1A1 (0.44) | PKMNR1I2ABCC9ABCC8KCNJ11 | |
| SCHEMBL7101748 | 0.81 | NR1I2 (0.43) | PKMNR1I2ABCC9ABCC8KCNJ11 | |
| SCHEMBL7095670 | 0.76 | ALDH1A1 (0.50) | PKMNR1I2ABCC9ABCC8KCNJ11 | |
| SCHEMBL7846869 | 0.76 | NR1I2 (0.46) | PKMNR1I2TP53TSHRCYP1A2 | |
| SCHEMBL7095276 | 0.73 | ABCC9 (0.59) | ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL9806914 | 0.68 | NR1I2 (0.76) | PKMNR1I2TP53TSHRCYP1A2 | |
| SCHEMBL10746069 | 0.67 | NR1I2 (0.64) | PKMNR1I2TP53TSHRCYP1A2 | |
| SCHEMBL24116896 | 0.67 | NR1I2 (0.55) | PKMNR1I2TP53TSHRCYP1A2 | |
| SCHEMBL24116895 | 0.67 | NR1I2 (0.55) | PKMNR1I2TP53TSHRCYP1A2 | |
| SCHEMBL30266531 | 0.67 | NR1I2 (0.55) | PKMNR1I2TP53TSHRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1278746-A2 | DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE | Abbott Laboratories (US) | 2003-01-29 | — | — | EP | disclosed |
| WO-2001083480-A2 | DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2001-11-08 | — | — | WO | disclosed |
| EP-1131322-A2 | DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2001-09-12 | — | — | EP | disclosed |
| WO-2000024741-A2 | DIHYDROPYRIDINE COMPOUNDS AND THEIR USE AS POTASSIUM CHANNEL OPENERS | ABBOTT LABORATORIES (US) | 2000-05-04 | — | — | WO | disclosed |