Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 5/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3354070 | 0.85 | USP2 (0.44) | USP2GAAHSD17B10SMN1; SMN2 | |
| SCHEMBL16856437 | 0.84 | HSD17B10 (0.37) | HSD17B10HPGDKMT2ACYP1A2CYP3A4 | |
| SCHEMBL16851189 | 0.83 | HSD17B10 (0.34) | USP2GAAHSD17B10HPGDKMT2A | |
| SCHEMBL11305107 | 0.82 | HPGD (0.51) | USP2GAAHSD17B10HPGDKMT2A | |
| SCHEMBL16823624 | 0.81 | USP2 (0.41) | USP2GAAKMT2AMEN1 | |
| SCHEMBL7711231 | 0.81 | USP2 (0.41) | USP2GAAKMT2AMEN1 | |
| SCHEMBL16856434 | 0.81 | HPGD (0.36) | HSD17B10HPGDKMT2ACYP1A2CYP3A4 | |
| SCHEMBL7708680 | 0.79 | USP2 (0.39) | USP2GAAHSD17B10KMT2AMIF | |
| SCHEMBL6862761 | 0.79 | USP2 (0.39) | USP2GAAHSD17B10KMT2AMIF | |
| SCHEMBL18143232 | 0.78 | RORC (0.53) | RORC |
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-2015095795-A1 | TETRAHYDRONAPHTHYRIDINE, BENZOXAZINE, AZA-BENZOXAZINE, AND RELATED BICYCLIC COMPOUNDS FOR INHIBITION OF RORgamma ACTIVITY AND THE TREATMENT OF DISEASE | MERCK SHARP & DOHME CORP. (US) | 2015-06-25 | — | — | WO | disclosed |