Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 2/20 | 0.33 |
| ▸ | UBE2N | P61088 | 2/20 | 0.33 |
| ▸ | GALR3 | O60755 | 1/20 | 0.33 |
| ▸ | IDE | P14735 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CAMK1D | Q8IU85 | 1/20 | 0.32 |
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 SCHEMBL7792374 | 1.00 | EPHX1 (0.36) | EPHX1RPS6KA3JAK3CNR1APAF1 | |
| Cyclohexylamine SCHEMBL8041263 | 0.89 | EPHX1 (0.38) | EPHX1RPS6KA3JAK3CNR1GPR35 | |
| Cyclohexylamine SCHEMBL8025626 | 0.83 | EPHX1 (0.40) | EPHX1RPS6KA3JAK3POLBRAB9A | |
| Cyclohexylamine SCHEMBL8025629 | 0.83 | EPHX1 (0.40) | EPHX1RPS6KA3JAK3POLBRAB9A | |
| SCHEMBL66819 | 0.80 | CES2 (0.46) | RPS6KA3JAK3POLBCES2 | |
| Lysine SCHEMBL8035212 | 0.79 | GSR (0.42) | EPHX1 | |
| Lysine SCHEMBL8035214 | 0.79 | GSR (0.42) | EPHX1 | |
| Cyclohexylamine SCHEMBL8035100 | 0.76 | POLB (0.42) | EPHX1GALR3RECQLPOLBRAB9A | |
| SCHEMBL6856533 | 0.75 | CES2 (0.41) | RPS6KA3JAK3GPR35POLBCES2 | |
| SCHEMBL18002523 | 0.75 | GPR35 (0.38) | GPR35POLB |
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 3 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 |
| US-6127381-A | A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY | LION BIOSCIENCE AG (DE) | 2000-10-03 | — | — | US | disclosed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | disclosed |