Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 5/20 | 0.48 |
| ▸ | PLAU | P00749 | 3/20 | 0.46 |
| ▸ | PLG | P00747 | 1/20 | 0.46 |
| ▸ | F12 | P00748 | 1/20 | 0.46 |
| ▸ | NCF1 | P14598 | 1/20 | 0.46 |
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4282133 | 0.98 | RAB9A (0.49) | RAB9ACNR2PLAUPLGF12 | |
| SCHEMBL29358323 | 0.93 | CNR2 (0.53) | RAB9ACNR2PLAUPLGF12 | |
| SCHEMBL111310 | 0.93 | CNR2 (0.53) | RAB9ACNR2PLAUPLGF12 | |
| Hydrochloric Acid SCHEMBL4433615 | 0.91 | CNR2 (0.51) | RAB9ACNR2PLAUPLGF12 | |
| Naphthalene SCHEMBL10758679 | 0.91 | CNR2 (0.51) | RAB9ACNR2PLAUPLGF12 | |
| SCHEMBL28198741 | 0.91 | CNR2 (0.51) | RAB9ACNR2PLAUPLGF12 | |
| SCHEMBL287165 | 0.91 | RAB9A (0.56) | RAB9ACNR2PLAUPLGF12 | |
| SCHEMBL22664584 | 0.90 | RAB9A (0.55) | RAB9ACNR2PLAUPLGF12 | |
| Hydrochloric Acid SCHEMBL3294760 | 0.90 | RAB9A (0.55) | RAB9ACNR2PLAUPLGF12 | |
| Ammonia Solution, Strong SCHEMBL28091481 | 0.90 | RAB9A (0.55) | RAB9ACNR2PLAUPLGF12 |
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-2009150196-A1 | N-THIAZOLYL-1, 2, 3, 4-TETRAHYDRO-6-ISOQUINOLINECARBOXAMIDE DERIVATIVES AS INHIBITORS OF STEAROYL COENZYME A DESATURASE | SMITHKLINE BEECHAM CORPORATION (US) | 2009-12-17 | — | — | WO | disclosed |