Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | GSK3B | P49841 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 5/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA3 | P07451 | 1/20 | 0.55 |
| ▸ | CA6 | P23280 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.55 |
| ▸ | MMP3 | P08254 | 1/20 | 0.50 |
| ▸ | P4HB | P07237 | 1/20 | 0.50 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.46 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.46 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | SHBG | P04278 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6738597 | 0.93 | GSK3B (0.63) | RAB9ANPC1GSK3BCA2CTBP2 | |
| SCHEMBL1642242 | 0.85 | NPC1 (0.81) | RAB9ANPC1CA2CAMK2AESR1 | |
| SCHEMBL1515793 | 0.84 | MAPT (0.61) | RAB9ANPC1GSK3BCA2CTBP2 | |
| SCHEMBL1515736 | 0.84 | CTBP2 (0.54) | RAB9ANPC1GSK3BCTBP2SAE1 | |
| SCHEMBL6210030 | 0.81 | RAB9A (0.59) | RAB9ANPC1GSK3B | |
| SCHEMBL6207604 | 0.81 | RAB9A (0.59) | RAB9ANPC1GSK3B | |
| SCHEMBL14191199 | 0.80 | NAMPT (0.60) | RAB9ANPC1GSK3BSAE1UBA2 | |
| SCHEMBL12671880 | 0.80 | GSK3B (0.49) | RAB9ANPC1GSK3BCA2CTBP2 | |
| SCHEMBL12835116 | 0.80 | RAB9A (0.72) | RAB9ANPC1CA2CAMK2AESR1 | |
| SCHEMBL27661290 | 0.78 | NPC1 (0.70) | RAB9ANPC1CA2CA12CA3 |
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-2008123821-A1 | 4, 5-DIHYDRO-LH-IMIDAZOL-2-AMINE DERIVATIVES FOR USE IN THE TREATMENT OF RESPIRATORY, CARDIOVASCULAR, NEUROLOGICAL OR GASTROINTESTINAL DISORDERS | ALBIREO AB (SE) | 2008-10-16 | — | — | WO | disclosed |