Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14394 | 1.00 | LTA4H (0.43) | LTA4HPKMPOLBTSHRBCHE | |
| SCHEMBL14250 | 1.00 | LTA4H (0.43) | LTA4HPKMPOLBTSHRBCHE | |
| SCHEMBL13743 | 0.91 | BCHE (0.43) | LTA4HPKMPOLBTSHRBCHE | |
| SCHEMBL14853256 | 0.83 | USP30 (0.44) | PKMBCHEUSP30CACNA1HCYP2D6 | |
| SCHEMBL14853433 | 0.83 | USP30 (0.44) | PKMBCHEUSP30CACNA1HCYP2D6 | |
| SCHEMBL17354482 | 0.83 | USP30 (0.44) | PKMBCHEUSP30CACNA1HCYP2D6 | |
| SCHEMBL14059 | 0.81 | LTA4H (0.48) | LTA4HBCHECACNA1HCYP2D6KCNH2 | |
| SCHEMBL14853442 | 0.81 | LTA4H (0.48) | LTA4HBCHECACNA1HCYP2D6KCNH2 | |
| SCHEMBL14850299 | 0.80 | CACNA1H (0.54) | POLBUSP30CACNA1HCYP2D6KCNH2 | |
| SCHEMBL13766 | 0.80 | LTA4H (0.46) | LTA4HBCHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011047323-A2 | ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB-X PHARMACEUTICALS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |