Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | EBP | Q15125 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7323772 | 0.99 | SIGMAR1 (0.40) | SIGMAR1TMEM97EBPCYP2C19CYP1A2 | |
| SCHEMBL29412738 | 0.81 | SIGMAR1 (0.56) | SIGMAR1TMEM97EBPCYP2C19CYP1A2 | |
| SCHEMBL7325355 | 0.81 | SIGMAR1 (0.56) | SIGMAR1TMEM97EBPCYP2C19CYP1A2 | |
| SCHEMBL8330350 | 0.80 | PYCR1 (0.45) | SIGMAR1TMEM97EBPCYP3A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL9148670 | 0.80 | SIGMAR1 (0.55) | SIGMAR1TMEM97EBPCYP2C19CYP1A2 | |
| Hydrochloric Acid SCHEMBL7310641 | 0.79 | PYCR1 (0.44) | SIGMAR1TMEM97EBPCYP3A4HTR2B | |
| SCHEMBL8329233 | 0.78 | SLC18A3 (0.36) | SIGMAR1TMEM97EBPOPRM1 | |
| SCHEMBL26765552 | 0.78 | SIGMAR1 (0.44) | SIGMAR1TMEM97EBPHTR2BHRH3 | |
| Hydrochloric Acid SCHEMBL7314216 | 0.78 | OPRM1 (0.36) | SIGMAR1TMEM97EBPOPRM1 | |
| SCHEMBL26765546 | 0.77 | SIGMAR1 (0.43) | SIGMAR1TMEM97EBPCYP2C19CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1154483-C | Use of amines to produce drugs for preventing tumour cell proliferation | ��ŵ��-ʥ�������ɷ�����˾ | 2004-06-23 | — | — | CN | disclosed |
| CN-1226825-A | Use of amines to produce drugs for preventing tumour cell proliferation | SANOFI SA (FR) | 1999-08-25 | — | — | CN | disclosed |
| EP-0917464-A1 | USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION | SANOFI (FR) | 1999-05-26 | — | — | EP | disclosed |
| WO-1998004251-A1 | USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION | SANOFI (FR) | 1998-02-05 | — | — | WO | disclosed |