Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | JMJD6 | Q6NYC1 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17476012 | 0.90 | CYP1A2 (0.47) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL1739337 | 0.88 | ALDH1A1 (0.61) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL18189686 | 0.88 | CNR2 (0.46) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL865041 | 0.87 | CYP1A2 (0.47) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL2413194 | 0.86 | CYP1A2 (0.46) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL20046287 | 0.86 | CYP1A2 (0.46) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17438006 | 0.86 | CYP1A2 (0.46) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL29625287 | 0.85 | CYP1A2 (0.49) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL29625288 | 0.85 | CYP1A2 (0.49) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL25786633 | 0.85 | RAB9A (0.57) | CYP1A2ALDH1A1KMT2ACYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2451450-A1 | NEW INHIBITORS OF PROLINE RACEMASE ENZYMES | Institut Pasteur (FR) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011004323-A1 | NEW INHIBITORS OF PROLINE RACEMASE ENZYMES | INSTITUT PASTEUR (FR) | 2011-01-13 | — | — | WO | disclosed |
| WO-2010117425-A1 | CERTAIN SUBSTITUTED PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | BIOGEN IDEC MA INC. (US) | 2010-10-14 | — | — | WO | disclosed |