Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2365013 | 0.85 | MTNR1A (0.47) | KCNN4MAPTCYP1A2CYP2D6MTNR1A | |
| SCHEMBL2364655 | 0.81 | CYP1A2 (0.42) | KCNN4MAPTCYP1A2CYP2D6MTNR1A | |
| SCHEMBL877145 | 0.72 | CYP2C9 (0.40) | CYP1A2 | |
| SCHEMBL11035564 | 0.71 | CYP1A2 (0.50) | KCNN4MAPTCYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL27159384 | 0.69 | CYP1A2 (0.44) | CYP1A2CYP2D6KMT2A | |
| SCHEMBL27159381 | 0.69 | CYP1A2 (0.44) | CYP1A2CYP2D6KMT2A | |
| SCHEMBL10741457 | 0.69 | KCNN4 (0.44) | KCNN4MAPTCYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL15881583 | 0.69 | KCNN4 (0.44) | KCNN4MAPTCYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL3322720 | 0.68 | MAPT (0.50) | KCNN4MAPTCYP1A2CYP2D6CES1 | |
| SCHEMBL31358110 | 0.68 | KCNN4 (0.47) | KCNN4MAPTCYP1A2CYP2D6CES1 |
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-2011092284-A1 | NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS | EUROSCREEN S.A. (BE) | 2011-08-04 | — | — | WO | disclosed |