Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPY1R | P25929 | 1/20 | 0.35 |
| ▸ | NPY2R | P49146 | 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 | |
|---|---|---|---|---|
| SCHEMBL19145312 | 0.80 | HSP90AA1 (0.49) | ALDH1A1TDP1HSP90AA1MAPTLMNA | |
| SCHEMBL10789838 | 0.72 | CNR2 (0.39) | ALDH1A1TDP1HSP90AA1MAPTLMNA | |
| SCHEMBL28463897 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL5178585 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL28455121 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL24521805 | 0.71 | TDP1 (0.42) | ALDH1A1TDP1MAPTLMNASMN1; SMN2 | |
| SCHEMBL31488235 | 0.71 | CNR2 (0.38) | ALDH1A1TDP1MAPTLMNASMN1; SMN2 | |
| SCHEMBL10883627 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL7114890 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL10884412 | 0.71 | ACHE (0.44) | TDP1MAPTSMN1; SMN2KMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1056082-C | Anticancer drug | XINGDA SCI SYSTEM CO BEIJING (CN) | 2000-09-06 | — | — | CN | disclosed |
| CN-1121832-A | Anticancer drug | XINGDA SCI SYSTEM CO BEIJING C (CN) | 1996-05-08 | — | — | CN | disclosed |