Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12384857 | 1.00 | THRB (0.49) | THRBATML3MBTL1ALDH1A1CASP6 | |
| SCHEMBL12142025 | 0.92 | GAA (0.53) | THRBATML3MBTL1ALDH1A1CASP6 | |
| SCHEMBL26461748 | 0.92 | GAA (0.53) | THRBATML3MBTL1ALDH1A1CASP6 | |
| SCHEMBL22971690 | 0.83 | CYP1A2 (0.41) | ALDH1A1TSHRHPGD | |
| SCHEMBL12384735 | 0.83 | CYP1A2 (0.41) | ALDH1A1TSHRHPGD | |
| SCHEMBL4762356 | 0.81 | GAA (0.61) | THRBATML3MBTL1ALDH1A1CASP6 | |
| SCHEMBL15827186 | 0.80 | EPHX2 (0.44) | ALDH1A1GAAKDM4EPOLBTSHR | |
| SCHEMBL12384822 | 0.80 | EPHX2 (0.44) | ALDH1A1GAAKDM4EPOLBTSHR | |
| SCHEMBL17084106 | 0.80 | SMN1; SMN2 (0.55) | HTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16980450 | 0.80 | SMN1; SMN2 (0.55) | HTTNPC1RAB9ASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8987268-B2 | Pyrrolopyridazine JAK3 inhibitors and their use for the treatment of inflammatory and autoimmune diseases | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-03-24 | — | — | US | disclosed |