Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 17/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL15569345 | 0.87 | ALDH1A1 (0.61) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL15569786 | 0.87 | RORC (0.46) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL21181630 | 0.85 | TAS1R3 (0.44) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL16888471 | 0.85 | TAS1R3 (0.44) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL15565811 | 0.81 | SLC6A3 (0.51) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL16981800 | 0.81 | TAS1R3 (0.42) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL16884658 | 0.81 | TAS1R3 (0.42) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL20275229 | 0.81 | TAS1R3 (0.48) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL18810137 | 0.81 | TAS1R3 (0.48) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL15570712 | 0.80 | ALDH1A1 (0.57) | RORCALDH1A1TAS1R3TAS1R1TAS1R2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104853757-A | 4-heteroaryl substituted benzoic acid compounds as ROR gamma T inhibitors and uses thereof | MERCK SHARP & DOHME | 2015-08-19 | — | — | CN | disclosed |