Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 11/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8033920 | 0.88 | HTT (0.49) | GPR84CYP2C19BACE1ALDH1A1HTT | |
| SCHEMBL8041875 | 0.85 | GPR84 (0.45) | GPR84BACE1ALDH1A1HTTNPSR1 | |
| SCHEMBL8050043 | 0.85 | MAPT (0.43) | ALDH1A1HTTNPSR1HPGDCYP1A2 | |
| SCHEMBL8043560 | 0.79 | BACE1 (0.45) | GPR84CYP2C19BACE1ALDH1A1NPSR1 | |
| SCHEMBL8042999 | 0.79 | BACE1 (0.42) | GPR84CYP2C19BACE1ALDH1A1CYP1A2 | |
| SCHEMBL8034186 | 0.78 | MET (0.41) | GPR84CYP2C19BACE1ALDH1A1CYP1A2 | |
| SCHEMBL8050073 | 0.78 | GPR84 (0.41) | GPR84CYP2C19BACE1ALDH1A1HTT | |
| SCHEMBL8051882 | 0.77 | BACE1 (0.44) | GPR84CYP2C19BACE1ALDH1A1CYP1A2 | |
| SCHEMBL8042828 | 0.75 | LMNA (0.42) | GPR84CYP2C19BACE1NPC1RAB9A | |
| SCHEMBL8033967 | 0.75 | CYP1A2 (0.42) | GPR84CYP2C19BACE1ALDH1A1CYP1A2 |
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-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |