Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 3/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 5/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | RBP4 | P02753 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6987678 | 0.81 | CYP3A4 (0.47) | GAACNR1TSHRCYP2C9SMN1; SMN2 | |
| SCHEMBL4677423 | 0.80 | KDM4E (0.56) | GAACYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4681386 | 0.80 | CYP3A4 (0.46) | GAACNR1TSHRCYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6990408 | 0.80 | KMT2A (0.51) | RAB9AGAACNR1CNR2RBP4 | |
| Hydrochloric Acid SCHEMBL6993204 | 0.79 | POLB (0.56) | GAACYP2C9 | |
| SCHEMBL6983830 | 0.77 | GPR139 (0.50) | NPC1LMNAP2RY12 | |
| SCHEMBL6987979 | 0.77 | KDM4E (0.59) | LMNASMN1; SMN2 | |
| SCHEMBL6987336 | 0.76 | CNR1 (0.59) | GAACNR1CNR2SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6988112 | 0.76 | GPR139 (0.49) | NPC1LMNAP2RY12 | |
| Hydrochloric Acid SCHEMBL6991722 | 0.76 | KDM4E (0.58) | LMNASMN1; SMN2 |
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-1343775-A2 | PIPERAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002048124-A2 | PIPERAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-20 | — | — | WO | disclosed |