Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.84 |
| ▸ | RAB9A | P51151 | 5/20 | 0.84 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.79 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | ESRRG | P62508 | 3/20 | 0.62 |
| ▸ | ESRRB | O95718 | 1/20 | 0.62 |
| ▸ | NAMPT | P43490 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | GFER | P55789 | 1/20 | 0.61 |
| ▸ | CA12 | O43570 | 1/20 | 0.61 |
| ▸ | CA1 | P00915 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL15679867 | 0.92 | NPC1 (0.72) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL5969191 | 0.91 | RAB9A (0.88) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL16900376 | 0.91 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2LMNAPOLB | |
| SCHEMBL14195833 | 0.89 | NPC1 (0.68) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL11710415 | 0.89 | NPC1 (0.68) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL9313096 | 0.89 | MAPT (0.71) | NPC1RAB9ASMN1; SMN2LMNAMAPT | |
| SCHEMBL13211715 | 0.89 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL4436883 | 0.88 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL15888499 | 0.87 | CA1 (0.86) | NPC1RAB9ALMNATP53POLB | |
| SCHEMBL11220601 | 0.86 | LMNA (0.85) | NPC1RAB9ASMN1; SMN2LMNAPOLB |
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-2007075555-A2 | COMBINATION OF AN H3 ANTAGONIST/INVERSE AGONIST AND AN APPETITE SUPPRESSANT | SCHERING CORPORATION (US) | 2007-07-05 | — | — | WO | disclosed |