Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.71 |
| ▸ | NPC1 | O15118 | 7/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.71 |
| ▸ | MEN1 | O00255 | 4/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | DRD4 | P21917 | 1/20 | 0.56 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.56 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7762758 | 0.94 | RAB9A (0.66) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL27645188 | 0.86 | RAB9A (0.75) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL7756335 | 0.85 | RAB9A (0.74) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL7963191 | 0.84 | RAB9A (0.81) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL7760900 | 0.83 | RAB9A (1.00) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL7760033 | 0.83 | RAB9A (0.79) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL7756351 | 0.82 | RAB9A (0.77) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL7761263 | 0.81 | RAB9A (0.81) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL29384882 | 0.81 | KMT2A (1.00) | RAB9ANPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL677470 | 0.81 | KMT2A (1.00) | RAB9ANPC1KMT2AMEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6291463-B1 | TREATMENT AND/OR PREVENTION OF NEUROPSYCHOLOGICAL DISORDERS | NEUROGEN CORPORATION | 2001-09-18 | — | — | US | claimed |