Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.41 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.41 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 4/20 | 0.40 |
| ▸ | HRH1 | P35367 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16607366 | 0.88 | MEN1 (0.49) | TSHRMEN1KMT2AALOX15ALDH1A1 | |
| SCHEMBL30839344 | 0.88 | MEN1 (0.49) | TSHRMEN1KMT2AALOX15ALDH1A1 | |
| SCHEMBL10852328 | 0.85 | THRA (0.47) | TSHRMEN1KMT2AALOX15ALDH1A1 | |
| SCHEMBL4469979 | 0.83 | ALOX15 (0.46) | ALOX15ALDH1A1HTR2CKDM4ECYP1A2 | |
| SCHEMBL17532246 | 0.82 | ALDH1A1 (0.47) | TSHRMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL16607367 | 0.82 | ALDH1A1 (0.47) | TSHRMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL10382093 | 0.82 | ALDH1A1 (0.53) | TSHRMEN1KMT2AALOX15ALDH1A1 | |
| SCHEMBL11855822 | 0.82 | NAAA (0.60) | TSHRMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL18506523 | 0.81 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL3966262 | 0.81 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2HRH2HRH1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1637524-A1 | 10-substituted 1-, 4, 7,-tris (carboxymethyl)-1,4,7,10-tetraazacyclo-dodecane derivative for use as contrast agents | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2006-03-22 | — | — | EP | disclosed |