Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.65 |
| ▸ | IDH1 | O75874 | 1/20 | 0.56 |
| ▸ | KDM1A | O60341 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.50 |
| ▸ | MET | P08581 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6568595 | 0.87 | CNR1 (0.59) | CNR1IDH1KDM1AMAOAMAOB | |
| SCHEMBL6567565 | 0.82 | CNR1 (0.71) | CNR1IDH1KDM1AEPHX2SMN1; SMN2 | |
| SCHEMBL3288027 | 0.81 | ROCK2 (0.61) | KDM1AMAOAMAOBEPHX2NPC1 | |
| SCHEMBL22834265 | 0.79 | CNR1 (1.00) | CNR1IDH1KDM1AMAOAMAOB | |
| SCHEMBL22834156 | 0.79 | CNR1 (1.00) | CNR1IDH1KDM1AMAOAMAOB | |
| SCHEMBL22834153 | 0.79 | CNR1 (1.00) | CNR1IDH1KDM1AMAOAMAOB | |
| SCHEMBL31054226 | 0.79 | SMN1; SMN2 (0.71) | POLBNPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL3293154 | 0.77 | KDM1A (0.52) | KDM1AMAOAMAOBEPHX2SMN1; SMN2 | |
| SCHEMBL3293152 | 0.77 | KDM1A (0.52) | KDM1AMAOAMAOBEPHX2SMN1; SMN2 | |
| SCHEMBL4113279 | 0.75 | EPHX2 (0.65) | MALT1EPHX2POLBNPC1RAB9A |
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 |