Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.71 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.63 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29615054 | 0.83 | CNR1 (1.00) | CNR1TAS1R3TAS1R1KMT2AMEN1 | |
| SCHEMBL22834166 | 0.83 | CNR1 (1.00) | CNR1TAS1R3TAS1R1KMT2AMEN1 | |
| SCHEMBL7844957 | 0.83 | CNR1 (0.80) | CNR1TAS1R3TAS1R1MAPTHTT | |
| SCHEMBL4351106 | 0.80 | CNR1 (0.68) | CNR1MAPTHTTKMT2AMEN1 | |
| SCHEMBL12994638 | 0.78 | CNR1 (0.76) | CNR1TAS1R3TAS1R1MAPTHTT | |
| SCHEMBL18317283 | 0.78 | CNR1 (0.76) | CNR1TAS1R3TAS1R1MAPTHTT | |
| SCHEMBL702289 | 0.78 | TAS1R3 (1.00) | CNR1TAS1R3TAS1R1MAPTHTT | |
| SCHEMBL6567300 | 0.77 | RAB9A (0.60) | CNR1MAPTKMT2AMEN1KDM4E | |
| SCHEMBL11701162 | 0.76 | CNR1 (0.64) | CNR1TAS1R3TAS1R1HTTKMT2A | |
| SCHEMBL6568451 | 0.75 | KDM4E (0.69) | CNR1MAPTHTTKMT2AMEN1 |
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 |