Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | TACR2 | P21452 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4977836 | 0.89 | STAT3 (0.41) | STAT3HTR2AITGB1ITGA4CYP3A4 | |
| SCHEMBL4984243 | 0.78 | NR1H4 (0.42) | KDM4ELTB4R2 | |
| SCHEMBL4982720 | 0.78 | CYP3A4 (0.46) | CYP3A4CYP2D6CYP2C9ADRA2AADRA2B | |
| SCHEMBL8802180 | 0.77 | ESR1 (0.49) | STAT3HTR2ACYP3A4ESR1ADRA2A | |
| SCHEMBL28751547 | 0.73 | CNR2 (0.51) | STAT3HTR2ACYP3A4ESR1ADRA2A | |
| SCHEMBL8801161 | 0.72 | STAT3 (0.47) | STAT3KCNH2CNR2 | |
| SCHEMBL28887265 | 0.72 | STAT3 (0.53) | STAT3CNR2 | |
| SCHEMBL3921499 | 0.72 | SIGMAR1 (0.51) | SIGMAR1ADRA2AALDH1A1TP53ADRA2B | |
| SCHEMBL3919033 | 0.72 | MEN1 (0.54) | SIGMAR1ADRA2AALDH1A1TP53ADRA2B | |
| SCHEMBL855620 | 0.72 | HDAC6 (0.55) | STAT3ALDH1A1CNR2 |
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-0751767-A4 | THERAPEUTIC GUANIDINES | CAMBRIDGE NEUROSCIENCE INC (US) | 1997-12-10 | — | — | EP | claimed |
| EP-0751767-A1 | THERAPEUTIC GUANIDINES | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1997-01-08 | — | — | EP | claimed |
| WO-1995020950-A1 | THERAPEUTIC GUANIDINES | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1995-08-10 | — | — | WO | claimed |