Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 6/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20204951 | 0.69 | CYP11B1 (0.45) | CYP11B1CYP11B2MEN1KMT2APOLB | |
| SCHEMBL1160189 | 0.67 | JAK3 (0.41) | TRPM8HTT | |
| SCHEMBL12772094 | 0.63 | RAB9A (0.49) | CYP2D6CYP2C9CYP2C19RECQLKMT2A | |
| SCHEMBL18997980 | 0.63 | CYP2D6 (0.52) | CYP2D6CYP2C9CYP2C19RECQLMEN1 | |
| SCHEMBL28125447 | 0.61 | MAPT (0.40) | CYP2D6MEN1KMT2ATP53HTT | |
| SCHEMBL12759448 | 0.60 | TGFBR1 (0.48) | MEN1KMT2APOLBTDP1MAPT | |
| SCHEMBL27975219 | 0.59 | TSHR (0.47) | CYP2C19CSF1RALDH1A1TSHR | |
| SCHEMBL12772108 | 0.59 | RAB9A (0.48) | CYP2D6CYP2C9CYP2C19RECQLHTT | |
| SCHEMBL12857 | 0.58 | ALDH1A1 (0.56) | CYP2D6CYP2C9CYP2C19RECQLALDH1A1 | |
| SCHEMBL30698368 | 0.57 | TAAR1 (0.50) | CYP2D6CYP2C9CYP2C19RECQLPOLB |
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-2459562-A1 | PYRROLO [1, 2-B]PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011014817-A1 | PYRROLO [1, 2-B] PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2011-02-03 | — | — | WO | disclosed |