Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.40 |
| ▸ | TPH1 | P17752 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | IKBKB | O14920 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | STAT6 | P42226 | 1/20 | 0.34 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8702051 | 1.00 | NOTUM (0.40) | NOTUMTPH1CHRM2CHRM4CHRM1 | |
| SCHEMBL14758902 | 0.80 | NCF1 (0.48) | NOTUMTPH1USP2ALDH1A1 | |
| SCHEMBL20723282 | 0.76 | LIPG (0.48) | — | |
| SCHEMBL23708109 | 0.76 | NPC1 (0.59) | NOTUMPRKDCALDH1A1STAT6 | |
| SCHEMBL23708472 | 0.76 | NPC1 (0.59) | NOTUMPRKDCALDH1A1STAT6 | |
| SCHEMBL16333323 | 0.74 | OPRK1 (0.40) | USP2NAPEPLD | |
| SCHEMBL8701795 | 0.73 | LTB4R (0.43) | CHRM2CHRM4CHRM1CHRM3NAPEPLD | |
| SCHEMBL27868110 | 0.72 | OPRM1 (0.51) | — | |
| Benzamide SCHEMBL7968675 | 0.72 | NAPEPLD (0.35) | TPH1ALDH1A1STAT6NAPEPLD | |
| SCHEMBL15893336 | 0.71 | NCF1 (0.52) | CHRM2CHRM4CHRM1CHRM3ALDH1A1 |
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-2005023799-A1 | FUSED BICYCLIC CARBOXAMIDE DERIVATIVES AND METHODS OF THEIR USE | ADOLOR CORPORATION (US) | 2005-03-17 | — | — | WO | disclosed |