Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | F13A1 | P00488 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | TGM1 | P22735 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | TACR3 | P29371 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | EIF2AK4 | Q9P2K8 | 2/20 | 0.34 |
| ▸ | SMO | Q99835 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28791123 | 0.88 | KDM4E (0.42) | KDM4ESMN1; SMN2F13A1TGM2TGM1 | |
| Hydrochloric Acid SCHEMBL27810222 | 0.86 | EIF2AK4 (0.36) | KDM4ELMNAHTTSMN1; SMN2F13A1 | |
| SCHEMBL1430013 | 0.84 | KDM4E (0.52) | KDM4ELMNAHTTSMN1; SMN2F13A1 | |
| SCHEMBL27810218 | 0.80 | KDM4E (0.37) | KDM4ELMNAHTTSMN1; SMN2TACR1 | |
| SCHEMBL12965691 | 0.77 | SMN1; SMN2 (0.44) | KDM4ELMNAHTTSMN1; SMN2F13A1 | |
| Hydrochloric Acid SCHEMBL1429800 | 0.77 | SMN1; SMN2 (0.44) | KDM4ELMNAHTTSMN1; SMN2F13A1 | |
| SCHEMBL1429768 | 0.72 | GAA (0.45) | KDM4ELMNAHTTF13A1TGM2 | |
| SCHEMBL12965414 | 0.71 | KDM4E (0.49) | KDM4ELMNAF13A1TGM2TGM1 | |
| Hydrochloric Acid SCHEMBL1430123 | 0.71 | KDM4E (0.59) | KDM4ELMNASMN1; SMN2F13A1TGM2 | |
| Hydrochloric Acid SCHEMBL1430220 | 0.70 | KDM4E (0.48) | KDM4ELMNAF13A1TGM2TGM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102099337-B | Piperazine derivatives useful as CAV2.2 calcium channel modulators | CONVERGENCE PHARMACEUTICALS | 2013-08-21 | — | — | CN | disclosed |
| CN-102099337-A | Piperazine derivatives useful as CAV2.2 calcium channel modulators | CONVERGENCE PHARMACEUTICALS | 2011-06-15 | — | — | CN | disclosed |