Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | LDHB | P07195 | 1/20 | 0.43 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL10598924 | 0.96 | HTR2A (0.48) | HTR2ALDHALDHBCALM1KDM4E | |
| SCHEMBL8096435 | 0.88 | CALM1 (0.44) | HTR2ALDHALDHBCALM1KDM4E | |
| SCHEMBL6547753 | 0.87 | LDHA (0.48) | HTR2ALDHALDHBCALM1KDM4E | |
| SCHEMBL8095518 | 0.85 | TLR8 (0.44) | HTR2ALDHALDHBCALM1LMNA | |
| SCHEMBL8095162 | 0.84 | TLR8 (0.49) | HTR2ABCL2L1TLR8ALOX5 | |
| SCHEMBL5249364 | 0.84 | HTR2A (0.63) | HTR2ALDHALDHBCALM1BCL2 | |
| SCHEMBL1452942 | 0.83 | ALDH1A1 (0.41) | KDM4EALDH1A1GAAHPGDALOX5 | |
| SCHEMBL19201121 | 0.83 | SIGMAR1 (0.46) | BCL2L1DRD1DRD3L3MBTL1LTB4R | |
| SCHEMBL8087327 | 0.82 | LIPG (0.49) | BCL2L1TLR8 | |
| SCHEMBL8100321 | 0.82 | LIPG (0.49) | BCL2L1TLR8 |
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-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |