Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.66 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.43 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.43 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9640545 | 0.79 | CYP1A2 (1.00) | CYP1A2ADORA3ALDH1A1KMT2AADORA1 | |
| SCHEMBL10397625 | 0.77 | KMT2A (0.43) | CYP1A2MAPK8ALDH1A1TDP1MEN1 | |
| SCHEMBL9737603 | 0.77 | SMN1; SMN2 (0.40) | CYP1A2MAPK8ADORA3ADORA2AALDH1A1 | |
| SCHEMBL2986990 | 0.76 | KMT2A (0.50) | CYP1A2ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL15058379 | 0.76 | TSHR (0.44) | CYP1A2MAPK8ADORA3ADORA2AALDH1A1 | |
| SCHEMBL15305693 | 0.74 | CYP1A2 (0.80) | CYP1A2MAPK8ADORA3ALDH1A1MAPK9 | |
| SCHEMBL2798552 | 0.73 | MAP2K7 (0.41) | CYP1A2MAPK8ADORA3ADORA2AADORA1 | |
| SCHEMBL1719546 | 0.73 | MAPK8 (0.41) | CYP1A2MAPK8ADORA3ADORA2AALDH1A1 | |
| SCHEMBL9505994 | 0.72 | CYP1A2 (0.57) | CYP1A2ADORA3ALDH1A1MEN1LMNA | |
| SCHEMBL24271910 | 0.71 | MAPK8 (1.00) | CYP1A2MAPK8ADORA3ADORA2ATDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0279366-B1 | PROCESS FOR THE PREPARATION OF PYRIMIDINES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-08-12 | — | — | EP | disclosed |
| US-4960887-A | REACTING PROPANEDIIMIDATE WITH CARBONIC ACID IMINEDERIVATIVE | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-10-02 | — | — | US | disclosed |
| EP-0279366-A2 | Process for the preparation of pyrimidines | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-08-24 | — | — | EP | disclosed |