Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9814691 | 0.87 | NOS1 (0.53) | KDM4EMAPTCYP3A4LMNAALDH1A1 | |
| SCHEMBL1982867 | 0.83 | KDM4E (0.47) | KDM4EMAPTCYP3A4LMNAALDH1A1 | |
| SCHEMBL9566886 | 0.82 | MEN1 (0.41) | KDM4EMAPTCYP3A4LMNAALDH1A1 | |
| SCHEMBL11369806 | 0.82 | GCK (0.49) | KDM4ELMNAALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL17019021 | 0.81 | ALDH1A1 (0.43) | KDM4EMAPTCYP3A4LMNAALDH1A1 | |
| SCHEMBL509101 | 0.80 | ALDH1A1 (0.42) | KDM4ECYP3A4ALDH1A1NOS3NOS1 | |
| SCHEMBL9129980 | 0.80 | LNPEP (0.44) | CYP2C9LNPEP | |
| SCHEMBL9566840 | 0.79 | KDM4E (0.34) | KDM4EMAPTALDH1A1LNPEP | |
| SCHEMBL1477890 | 0.79 | ALDH1A1 (0.43) | KDM4EMAPTCYP3A4LMNAALDH1A1 | |
| SCHEMBL14086531 | 0.79 | ALDH1A1 (0.41) | KDM4EMAPTCYP3A4LMNAALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1875239-B1 | A METHOD FOR THE PREPARATION OF IMAGING PROBES USING CLICK CHEMISTRY | SIEMENS MEDICAL SOLUTIONS (US) | 2011-10-05 | — | — | EP | disclosed |
| EP-1875239-A2 | A METHOD FOR THE PREPARATION OF IMAGING PROBES USING CLICK CHEMISTRY | Siemens Medical Solutions USA, Inc. (US) | 2008-01-09 | — | — | EP | disclosed |
| US-20060269942-A1 | In situ click chemistry method for screening high affinity molecular imaging probes | SIEMENS MEDICAL SOLUTIONS USA, INC. | 2006-11-30 | — | — | US | disclosed |
| WO-2006116736-A2 | A METHOD FOR THE PREPARATION OF IMAGING PROBES USING CLICK CHEMISTRY | SIEMENS MEDICAL SOLUTIONS USA, INC. (US) | 2006-11-02 | — | — | WO | disclosed |