Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 4/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | IDH2 | P48735 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8463123 | 0.96 | ESR1 (0.38) | GBA1IDH1ESR1SMN1; SMN2KDM4E | |
| SCHEMBL8468515 | 0.93 | IDH1 (0.42) | GBA1IDH1ESR1SMN1; SMN2KDM4E | |
| SCHEMBL8466516 | 0.89 | ESR1 (0.45) | GBA1IDH1ESR1SMN1; SMN2KDM4E | |
| SCHEMBL10821122 | 0.82 | CDK2 (0.34) | GBA1ESR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8853415 | 0.82 | GBA1 (0.34) | GBA1IDH1CDK2CCNE1HRH4 | |
| SCHEMBL8465534 | 0.80 | CSNK2A2 (0.36) | GBA1ESR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL9061566 | 0.78 | ESR1 (0.55) | IDH1ESR1HRH4 | |
| SCHEMBL10862760 | 0.78 | CA1 (0.37) | IDH1ESR1SMN1; SMN2KDM4EHRH4 | |
| SCHEMBL20164517 | 0.78 | CDK2 (0.41) | CDK2CCNE1HRH4CSNK2A2CSNK2B | |
| SCHEMBL20164515 | 0.78 | CDK2 (0.41) | CDK2CCNE1HRH4CSNK2A2CSNK2B |
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-0178611-B1 | PROCESS FOR THE PREPARATION OF N,N',N''-TRIS(2-HYDROXYPROPYL) MELAMINE | BASF Aktiengesellschaft (DE) | 1992-06-17 | — | — | EP | disclosed |
| US-4618676-A | BY-PRODUCT INHIBITON USING AN ACID CATALYST; STOICHIOMETRY | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | disclosed |
| EP-0178611-A2 | Process for the preparation of N,N',N''-tris(2-hydroxypropyl) melamine | BASF Aktiengesellschaft (DE) | 1986-04-23 | — | — | EP | disclosed |