Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.59 |
| ▸ | MAOA | P21397 | 2/20 | 0.59 |
| ▸ | MAOB | P27338 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.58 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | TGM2 | P21980 | 3/20 | 0.54 |
| ▸ | CCR1 | P32246 | 1/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | F13A1 | P00488 | 2/20 | 0.52 |
| ▸ | TGM1 | P22735 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14824682 | 0.89 | NAMPT (0.65) | KDM1AMAOAMAOBSMN1; SMN2HRH3 | |
| SCHEMBL4035554 | 0.86 | SMN1; SMN2 (0.72) | SMN1; SMN2NPC1RAB9AENPP2CYP2C19 | |
| SCHEMBL6749001 | 0.85 | SMN1; SMN2 (0.67) | SMN1; SMN2NPC1RAB9ACYP2C19CCR1 | |
| SCHEMBL8010255 | 0.84 | HRH3 (0.59) | KDM1AMAOAMAOBHRH3RCOR1 | |
| SCHEMBL25329767 | 0.83 | SMN1; SMN2 (0.64) | SMN1; SMN2NPC1RAB9AENPP2CYP2C19 | |
| SCHEMBL15747803 | 0.83 | SMN1; SMN2 (0.64) | SMN1; SMN2NPC1RAB9ACYP2C19CCR1 | |
| SCHEMBL15531061 | 0.83 | ENPP2 (0.59) | KDM1ASMN1; SMN2NPC1RAB9ARCOR1 | |
| SCHEMBL15379737 | 0.82 | ENPP2 (0.64) | SMN1; SMN2NPC1RAB9AENPP2CYP2C19 | |
| SCHEMBL7503285 | 0.82 | SMN1; SMN2 (0.62) | SMN1; SMN2HRH3NPC1RAB9ACYP2C19 | |
| SCHEMBL6745783 | 0.82 | SMN1; SMN2 (0.62) | SMN1; SMN2NPC1RAB9AENPP2CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313307-B1 | DEBLOCKING, DEPROTECTING; CATALYTIC HYDROGENATION, ALKYLATION; PREPARING MICROBIOCIDES AGAINST STAPHYLOCOCCUS, STREPTOCOCCUS, MYCOBACTERIUM, AND CLOSTRIDIUM | PHARMACIA & UPJOHN COMPANY | 2001-11-06 | — | — | US | disclosed |