Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | PPIA | P62937 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | TYK2 | P29597 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL5022120 | 0.85 | ITGA4 (0.41) | KMT2AMEN1CES2CES1TYK2 | |
| SCHEMBL13328951 | 0.84 | CES2 (0.52) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL31259499 | 0.83 | CES2 (0.61) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL8170361 | 0.81 | MEN1 (0.49) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL9363197 | 0.78 | KMT2A (0.57) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL11099551 | 0.78 | CES2 (0.54) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL27309508 | 0.77 | KMT2A (0.55) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL20387809 | 0.77 | ALDH1A1 (0.50) | PPIAJAK2JAK1TYK2RAB9A | |
| SCHEMBL10572106 | 0.77 | PPIA (0.54) | KMT2AMEN1CES2CES1PPIA | |
| SCHEMBL6989541 | 0.76 | JAK2 (0.53) | KMT2AMEN1CES2CES1PPIA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012064744-A2 | TETRAHYDROQUINOLINE AND RELATED BICYCLIC COMPOUNDS FOR INHIBITION OF RORϒ ACTIVITY AND THE TREATMENT OF DISEASE | LYCERA CORPORATION (US) | 2012-05-18 | — | — | WO | disclosed |