Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL12417811 | 0.84 | GPR84 (0.39) | GPR84TDO2NAPRTMAPTMTNR1A | |
| SCHEMBL3477845 | 0.84 | ALOX5AP (0.36) | GPR84TDO2MAPTALOX5APFEN1 | |
| SCHEMBL12417843 | 0.84 | GPR84 (0.40) | GPR84TDO2MAPTCYP3A4CYP11B2 | |
| SCHEMBL2194154 | 0.82 | NAPRT (0.38) | NAPRTMAPTMTNR1ATAAR1DYRK1A | |
| SCHEMBL4562592 | 0.78 | MAP2K1 (0.34) | GPR84MAPTMTNR1ACYP3A4DYRK1A | |
| SCHEMBL2194158 | 0.77 | MTNR1A (0.45) | NAPRTMTNR1A | |
| SCHEMBL1830980 | 0.76 | NAPRT (0.33) | NAPRTMTNR1ADYRK1A | |
| SCHEMBL1830977 | 0.76 | SSTR4 (0.38) | — | |
| SCHEMBL13437106 | 0.76 | NAPRT (0.42) | TDO2NAPRTRETDYRK1AMET | |
| SCHEMBL2409903 | 0.76 | DHODH (0.40) | GPR84TDO2NAPRTMAPTMTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2318390-B1 | PYRROLE COMPOUNDS | TAKEDA PHARMACEUTICAL (JP) | 2013-05-01 | — | — | EP | disclosed |