Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL15088888 | 1.00 | S1PR1 (0.47) | S1PR1S1PR5SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL13497258 | 1.00 | S1PR1 (0.47) | S1PR1S1PR5SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL15088881 | 1.00 | S1PR1 (0.47) | S1PR1S1PR5SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL13497256 | 1.00 | S1PR1 (0.47) | S1PR1S1PR5SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL15088847 | 1.00 | S1PR1 (0.47) | S1PR1S1PR5SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL16501521 | 0.90 | SIGMAR1 (0.44) | SIGMAR1ALDH1A1KDM4ETDP1HSD11B1 | |
| SCHEMBL16501536 | 0.90 | SIGMAR1 (0.44) | SIGMAR1ALDH1A1KDM4ETDP1HSD11B1 | |
| SCHEMBL13497349 | 0.75 | ABAT (0.46) | ALDH1A1KDM4ETDP1LMNAHTT | |
| SCHEMBL13497336 | 0.75 | ABAT (0.46) | ALDH1A1KDM4ETDP1LMNAHTT | |
| SCHEMBL13497265 | 0.75 | ABAT (0.46) | ALDH1A1KDM4ETDP1LMNAHTT |
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-2318383-B1 | PROCESS FOR PREPARING CYCLOALKYL-SUBSTITUTED PIPERAZINE COMPOUNDS | BOEHRINGER INGELHEIM INT (DE) | 2013-07-03 | — | — | EP | disclosed |
| WO-2010017850-A1 | PROCESS FOR PREPARING CYCLOALKYL-SUBSTITUTED PIPERAZINE COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-02-18 | — | — | WO | disclosed |