Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR1 | P30872 | 5/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 5/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.33 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.33 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 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 | |
|---|---|---|---|---|
| SCHEMBL16981787 | 0.80 | RORC (0.43) | S1PR5RORCENPP2PDE4APDE4B | |
| SCHEMBL15566446 | 0.72 | ALDH1A1 (0.55) | RORCPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL15566857 | 0.72 | CA12 (0.46) | S1PR5RORCPDE4APDE4BPDE4C | |
| SCHEMBL16984609 | 0.72 | RORC (0.43) | RORCENPP2PDE4APDE4BPDE4C | |
| SCHEMBL15568108 | 0.70 | RORC (0.47) | RORCPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL21855668 | 0.62 | SLC6A4 (0.38) | RORCENPP2PDE4DHRH1 | |
| SCHEMBL9281104 | 0.62 | SLC6A4 (0.65) | RORCHRH1EPHX2 | |
| SCHEMBL24088392 | 0.60 | L3MBTL1 (0.44) | ENPP2 | |
| SCHEMBL21855519 | 0.60 | L3MBTL1 (0.41) | RORCPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL18190567 | 0.60 | SLC6A2 (0.45) | RORCEPHX2 |
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-9745265-B2 | 4-heteroaryl substituted benzoic acid compounds as RORgammaT inhibitors and uses thereof | MERCK SHARP & DOHME CORP. (US) | 2017-08-29 | — | — | US | disclosed |