Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | FABP6 | P51161 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL994345 | 0.95 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3GRIN2BHRH3 | |
| SCHEMBL2687312 | 0.95 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3GRIN2BHRH3 | |
| SCHEMBL239923 | 0.88 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3GRIN2BBCHE | |
| SCHEMBL605459 | 0.88 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3GRIN2BBCHE | |
| SCHEMBL4766363 | 0.88 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3GRIN2BBCHE | |
| Hydrochloric Acid SCHEMBL697481 | 0.87 | SLC6A2 (0.61) | SLC6A2SLC6A4SLC6A3GRIN2BBCHE | |
| Hydrochloric Acid SCHEMBL697480 | 0.87 | SLC6A2 (0.61) | SLC6A2SLC6A4SLC6A3GRIN2BBCHE | |
| SCHEMBL433970 | 0.82 | GRIN2B (0.69) | GRIN2BHRH3BCHEACHEBACE1 | |
| SCHEMBL20267493 | 0.82 | GRIN2B (0.56) | SLC6A2SLC6A4SLC6A3GRIN2BHRH3 | |
| SCHEMBL4697491 | 0.82 | GRIN2B (0.56) | SLC6A2SLC6A4SLC6A3GRIN2BHRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1966163-A1 | PYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF PKC-THETA | Boehringer Ingelheim International GmbH (DE) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007076247-A1 | PYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF PKC-THETA | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-07-05 | — | — | WO | disclosed |