Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ITK | Q08881 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8215134 | 0.86 | ITK (0.35) | KMT2AMEN1GRM1ALDH1A1KDM4E | |
| SCHEMBL24737398 | 0.80 | CCR1 (0.46) | KMT2AMEN1KDM4ELMNAITK | |
| SCHEMBL29302315 | 0.79 | PLAU (0.47) | KDM4ELMNAITKMAPTCCR1 | |
| SCHEMBL29302314 | 0.79 | ITK (0.46) | LMNAITKMAPTCCR1CCR5 | |
| SCHEMBL29879145 | 0.79 | ITK (0.46) | LMNAITKMAPTCCR1CCR5 | |
| SCHEMBL4731345 | 0.77 | P2RX7 (0.49) | KMT2AMEN1GRM1P2RX7ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4728933 | 0.76 | P2RX7 (0.48) | KMT2AMEN1GRM1P2RX7ALDH1A1 | |
| SCHEMBL4729426 | 0.75 | ALDH1A1 (0.49) | KMT2AMEN1GRM1P2RX7ALDH1A1 | |
| SCHEMBL4728861 | 0.75 | HPGDS (0.46) | GRM1ITK | |
| SCHEMBL24737400 | 0.75 | NOS3 (0.46) | KMT2AMEN1ALDH1A1KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008035049-A1 | ADAMANTANYL-(CYCLOPROPYL)-KETONES AS METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2008-03-27 | — | — | WO | disclosed |