Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PAM | P19021 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | DGKA | P23743 | 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 | |
|---|---|---|---|---|
| SCHEMBL3828853 | 0.84 | CYP1A2 (0.38) | CYP1A2KMT2APAMCYP3A4TSHR | |
| SCHEMBL4835509 | 0.83 | CYP1A2 (0.52) | CYP1A2KMT2APAMCYP3A4TSHR | |
| SCHEMBL11514409 | 0.83 | CYP1A2 (0.52) | CYP1A2KMT2APAMCYP3A4TSHR | |
| SCHEMBL6206573 | 0.82 | ALDH1A1 (0.47) | KMT2ATSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL3823343 | 0.80 | CYP1A2 (0.39) | CYP1A2KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL7073725 | 0.79 | CYP1A2 (0.55) | CYP1A2KMT2APAMCYP3A4TSHR | |
| SCHEMBL14930173 | 0.79 | L3MBTL1 (0.46) | CYP1A2KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL5089905 | 0.78 | CYP1A2 (0.39) | CYP1A2KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL11598732 | 0.76 | KMT2A (0.54) | CYP1A2KMT2APAMCYP3A4TSHR | |
| SCHEMBL7971092 | 0.76 | KMT2A (0.54) | CYP1A2KMT2APAMCYP3A4TSHR |
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-1581535-B3 | PYRROLOPYRIDAZINE DERIVATIVES | ASTELLAS PHARMA INC (JP) | 2009-09-02 | — | — | EP | disclosed |
| EP-1581535-B9 | PYRROLOPYRIDAZINE DERIVATIVES | ASTELLAS PHARMA INC (JP) | 2008-03-19 | — | — | EP | disclosed |
| EP-1581535-B1 | PYRROLOPYRIDAZINE DERIVATIVES | ASTELLAS PHARMA INC (JP) | 2007-10-24 | — | — | EP | disclosed |