Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LATS1 | O95835 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | EIF2AK4 | Q9P2K8 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL16236313 | 0.98 | ALDH1A1 (0.56) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| Hydrochloric Acid SCHEMBL27529179 | 0.98 | ALDH1A1 (0.56) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| SCHEMBL18096405 | 0.82 | PLD1 (0.58) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| SCHEMBL31713198 | 0.81 | HTR1A (0.39) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| Hydrochloric Acid SCHEMBL23124046 | 0.80 | PLD1 (0.57) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| SCHEMBL18096330 | 0.78 | JAK2 (0.46) | ALDH1A1KDM4EPRKCQLATS1HDAC1 | |
| SCHEMBL31713196 | 0.78 | ALDH1A1 (0.53) | ALDH1A1KDM4EHSD17B10CYP2D6CYP1A2 | |
| Hydrochloric Acid SCHEMBL28966651 | 0.76 | EIF2AK4 (0.47) | ALDH1A1KDM4EPRKCQLATS1HDAC1 | |
| SCHEMBL19035625 | 0.75 | LATS1 (0.45) | KDM4EPRKCQLATS1HDAC1CSNK1E | |
| Hydrochloric Acid SCHEMBL30576221 | 0.74 | PRKCQ (0.49) | ALDH1A1KDM4EHSD17B10HPGDPRKCQ |
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-2014184248-A2 | TRPA1 ANTAGONIST COMPOUNDS | Acturum Life Science AB (SE) | 2014-11-20 | — | — | WO | disclosed |