Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.49 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.46 |
| ▸ | CD74 | P04233 | 1/20 | 0.46 |
| ▸ | MIF | P14174 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 13/20 | 0.44 |
| ▸ | MEN1 | O00255 | 11/20 | 0.44 |
| ▸ | NPC1 | O15118 | 10/20 | 0.44 |
| ▸ | RAB9A | P51151 | 9/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL8035113 | 0.92 | KMT2A (0.44) | KDM4EPIM1CCR1CD74MIF | |
| Cyclohexylamine SCHEMBL8025677 | 0.87 | KMT2A (0.40) | KDM4EPIM1CCR1CD74MIF | |
| Cyclohexylamine SCHEMBL8025671 | 0.87 | KMT2A (0.40) | KDM4EPIM1CCR1CD74MIF | |
| SCHEMBL29406155 | 0.85 | KDM4E (0.64) | KDM4EPIM1CCR1CD74MIF | |
| SCHEMBL29694379 | 0.85 | KDM4E (0.64) | KDM4EPIM1CCR1CD74MIF | |
| SCHEMBL279696 | 0.85 | KDM4E (0.64) | KDM4EPIM1CCR1CD74MIF | |
| SCHEMBL28500579 | 0.83 | KDM4E (0.62) | KDM4ECCR1CD74MIFKMT2A | |
| SCHEMBL28904663 | 0.83 | KDM4E (0.62) | KDM4ECCR1CD74MIFKMT2A | |
| SCHEMBL29783026 | 0.83 | KDM4E (0.62) | KDM4ECCR1CD74MIFKMT2A | |
| SCHEMBL31157804 | 0.83 | KDM4E (0.62) | KDM4ECCR1CD74MIFKMT2A |
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-1076649-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 2001-02-21 | — | — | EP | disclosed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | disclosed |