Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PREP | P48147 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 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 | |
|---|---|---|---|---|
| SCHEMBL6209447 | 0.87 | ALDH1A1 (0.41) | ALDH1A1GAACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6211364 | 0.81 | DPP4 (0.45) | ALDH1A1CYP3A4CYP2D6CYP2C9HTT | |
| SCHEMBL6209824 | 0.81 | DPP4 (0.47) | ALDH1A1GAATSHRNAMPTLMNA | |
| SCHEMBL6212946 | 0.80 | RAB9A (0.47) | ALDH1A1GAAHTTNAMPTLMNA | |
| SCHEMBL6208880 | 0.80 | KDM4E (0.42) | ALDH1A1GAACYP3A4TSHR | |
| SCHEMBL5941964 | 0.80 | PKM (0.38) | ALDH1A1TSHRNAMPTLMNADPP4 | |
| SCHEMBL6212587 | 0.80 | NAMPT (0.42) | ALDH1A1NAMPTLMNADPP4 | |
| SCHEMBL6211394 | 0.80 | LMNA (0.40) | ALDH1A1NAMPTLMNADPP4 | |
| SCHEMBL4048640 | 0.80 | CTSK (0.51) | — | |
| SCHEMBL6258369 | 0.79 | LMNA (0.44) | PREPALDH1A1HTTNAMPTLMNA |
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-1546150-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | Amura Therapeutics Limited (GB) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004007501-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | AMURA THERAPEUTICS LIMITED (GB) | 2004-01-22 | — | — | WO | disclosed |