Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 6/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28160719 | 0.86 | NPC1 (0.49) | TDP1DPP7NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL586754 | 0.86 | NPC1 (0.49) | TDP1DPP7NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3210075 | 0.84 | NPC1 (0.50) | TDP1NPC1RAB9ASMN1; SMN2MAPT | |
| Phenylethyl Alcohol SCHEMBL7240959 | 0.71 | TDP1 (0.94) | TDP1SMN1; SMN2ALDH1A1HPGDALOX15 | |
| SCHEMBL28626730 | 0.71 | CYP19A1 (0.43) | TDP1NPC1RAB9ASMN1; SMN2MAPT | |
| Phenylethyl Alcohol SCHEMBL28192302 | 0.69 | TDP1 (0.73) | TDP1SMN1; SMN2ALDH1A1HPGDALOX15 | |
| SCHEMBL1472474 | 0.69 | CHRNB2 (0.41) | NPC1RAB9ASMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL29090498 | 0.69 | RAB9A (0.51) | TDP1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL31512564 | 0.69 | OGG1 (0.39) | TDP1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL2564307 | 0.69 | NPC1 (0.51) | TDP1NPC1RAB9ASMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105612248-A | Encapsulates | PGIO SA | 2016-05-25 | — | — | CN | disclosed |