Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3711153 | 1.00 | KCNN4 (0.40) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL8583526 | 0.81 | KCNN4 (0.42) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL17267041 | 0.81 | KCNN4 (0.42) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL24826099 | 0.81 | KCNN4 (0.42) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL7206142 | 0.79 | PDK1 (0.42) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL18674881 | 0.79 | KCNN4 (0.41) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL8716679 | 0.77 | KCNN4 (0.44) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL30603799 | 0.77 | KCNN4 (0.40) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL17080367 | 0.77 | KCNN4 (0.40) | KCNN4ALDH1A1TSHRTDP1ACHE | |
| SCHEMBL28879487 | 0.77 | KCNN4 (0.44) | KCNN4ALDH1A1TSHRTDP1ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2358688-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | Amira Pharmaceuticals, Inc. (US) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010077883-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | disclosed |