Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ECE2 | P0DPD6 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | ME2 | P23368 | 1/20 | 0.45 |
| ▸ | ME1 | P48163 | 1/20 | 0.45 |
| ▸ | ME3 | Q16798 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12988833 | 0.95 | ECE2 (0.51) | SMN1; SMN2NPC1HPGDECE2POLB | |
| SCHEMBL31424351 | 0.82 | SMN1; SMN2 (0.60) | SMN1; SMN2NPC1HPGDECE2POLB | |
| SCHEMBL6567577 | 0.82 | KMT2A (0.58) | SMN1; SMN2NPC1HPGDECE2POLB | |
| SCHEMBL13826054 | 0.81 | SYK (0.47) | SMN1; SMN2POLBALDH1A1HTT | |
| SCHEMBL6568665 | 0.80 | KMT2A (0.60) | SMN1; SMN2NPC1HPGDECE2POLB | |
| SCHEMBL14190970 | 0.80 | HRH3 (0.62) | HRH3ALDH1A1 | |
| SCHEMBL16002966 | 0.80 | SYK (0.48) | SMN1; SMN2KMT2AMEN1ALDH1A1HTT | |
| SCHEMBL3170967 | 0.79 | SMN1; SMN2 (0.70) | SMN1; SMN2NPC1HPGDECE2POLB | |
| Hydrochloric Acid SCHEMBL4384126 | 0.79 | HRH3 (0.63) | HRH3ALDH1A1 | |
| SCHEMBL5169637 | 0.79 | SMN1; SMN2 (0.56) | SMN1; SMN2NPC1HPGDECE2POLB |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |