Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12816129 | 0.79 | ALDH1A1 (0.35) | KIF11CYP1A2ALDH1A1CA2CYP2C19 | |
| SCHEMBL11843489 | 0.77 | SLC6A4 (0.43) | CYP1A2CYP2A6GPR84LTA4HHTR1A | |
| SCHEMBL542478 | 0.72 | LTA4H (0.58) | LMNAALDH1A1LTA4HIDO1TAAR1 | |
| SCHEMBL12401792 | 0.72 | CA1 (0.42) | LPAR1GAAALDH1A1CA1CA2 | |
| SCHEMBL6978758 | 0.72 | CHRM2 (0.49) | LTA4HIDO1TAAR1KMT2A | |
| SCHEMBL12816687 | 0.71 | CA2 (0.32) | KIF11ALDH1A1CA2 | |
| SCHEMBL12894336 | 0.71 | MAOB (0.49) | HTR1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14492377 | 0.71 | CA1 (0.46) | LPAR1GAAALDH1A1CA1CA2 | |
| SCHEMBL11165576 | 0.70 | CA1 (0.48) | CYP1A2CYP2A6GAAALDH1A1GPR84 | |
| SCHEMBL3246008 | 0.69 | IDO1 (0.46) | GAAALDH1A1CA1CA2IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3044216-A2 | NOVEL AND SPECIFIC INHIBITORS OF CYTOCHROME P450 26 RETINOIC ACID HYDROXYLASE | University of Washington through its Center for Commercialization (US) | 2016-07-20 | — | — | EP | disclosed |
| WO-2015026990-A2 | NOVEL AND SPECIFIC INHIBITORS OF CYTOCHROME P450 26 RETINOIC ACID HYDROLASE | UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) | 2015-02-26 | — | — | WO | disclosed |