Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3721047 | 0.89 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2NPC1LMNAKDM4E | |
| SCHEMBL3718590 | 0.89 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2NPC1LMNAHTT | |
| SCHEMBL3727042 | 0.86 | DRD2 (0.47) | ALDH1A1SMN1; SMN2NPC1LMNAHTT | |
| SCHEMBL3720273 | 0.85 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2NPC1LMNAKDM4E | |
| SCHEMBL3724503 | 0.84 | CYP11B2 (0.46) | ALDH1A1SMN1; SMN2NPC1LMNAKDM4E | |
| SCHEMBL3721161 | 0.84 | MAPT (0.44) | ALDH1A1SMN1; SMN2NPC1LMNAHTT | |
| SCHEMBL3721778 | 0.84 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2NPC1LMNAHTT | |
| SCHEMBL3720203 | 0.84 | KMT2A (0.42) | ALDH1A1SMN1; SMN2NPC1LMNAHTT | |
| SCHEMBL3721099 | 0.84 | SMN1; SMN2 (0.44) | ALDH1A1SMN1; SMN2NPC1LMNAKDM4E | |
| SCHEMBL3724712 | 0.83 | LMNA (0.42) | ALDH1A1SMN1; SMN2NPC1LMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-8614201-B2 | Heterocyclic amides as modulators of TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2013-12-24 | — | — | US | claimed |
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | claimed |
| US-8614201-B2 | Heterocyclic amides as modulators of TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2013-12-24 | — | — | US | disclosed |