Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.47 |
| ▸ | F10 | P00742 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL4592548 | 0.86 | F10 (0.52) | ACKR3F10 | |
| SCHEMBL4592552 | 0.86 | F10 (0.52) | ACKR3F10 | |
| SCHEMBL4592230 | 0.83 | ACKR3 (0.66) | GAANPSR1RXFP1KDM4EACKR3 | |
| SCHEMBL3449148 | 0.83 | ACKR3 (0.66) | GAANPSR1RXFP1KDM4EACKR3 | |
| SCHEMBL3449150 | 0.83 | ACKR3 (0.66) | GAANPSR1RXFP1KDM4EACKR3 | |
| SCHEMBL4592619 | 0.83 | ACKR3 (0.39) | NPSR1ACKR3KMT2AMEN1 | |
| SCHEMBL4592144 | 0.81 | ACKR3 (0.40) | KDM4EACKR3NPC1 | |
| SCHEMBL14720130 | 0.80 | CHIT1 (0.52) | KDM4EALDH1A1KMT2AHDAC3HDAC4 | |
| SCHEMBL4592808 | 0.78 | HPGD (0.52) | NPSR1NPC1RAB9ATDP1HPGD | |
| SCHEMBL4592805 | 0.78 | HPGD (0.52) | NPSR1NPC1RAB9ATDP1HPGD |
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-1877404-A2 | NOVEL CYCLIC AMINES | F. Hoffmann-Roche AG (CH) | 2008-01-16 | — | — | EP | disclosed |
| WO-2006114401-A2 | NOVEL CYCLIC AMINES | F. HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | WO | disclosed |