Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.53 |
| ▸ | MTOR | P42345 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4367399 | 0.84 | TSHR (0.71) | ALDH1A1KDM4ESMN1; SMN2LMNAMAPK1 | |
| SCHEMBL3247291 | 0.81 | CNR1 (0.56) | PIK3CAMTORKMT2APOLBMEN1 | |
| SCHEMBL12673399 | 0.81 | TSHR (0.52) | ALDH1A1KDM4ESMN1; SMN2LMNAPIK3CA | |
| SCHEMBL3408339 | 0.80 | NPC1 (0.52) | ALDH1A1KDM4ENPSR1SMN1; SMN2LMNA | |
| SCHEMBL29952479 | 0.80 | NPC1 (0.52) | ALDH1A1KDM4ENPSR1SMN1; SMN2LMNA | |
| SCHEMBL1270038 | 0.79 | KMT2A (0.53) | ALDH1A1NPSR1SMN1; SMN2LMNAKMT2A | |
| SCHEMBL3343329 | 0.79 | PKM (0.58) | ALDH1A1KDM4ESMN1; SMN2LMNAPIK3CA | |
| SCHEMBL20627051 | 0.79 | POLB (0.53) | ALDH1A1SMN1; SMN2LMNAKMT2APOLB | |
| SCHEMBL1911955 | 0.79 | ALDH1A1 (0.63) | ALDH1A1KDM4ENPSR1SMN1; SMN2LMNA | |
| SCHEMBL30397969 | 0.79 | POLB (0.53) | ALDH1A1SMN1; SMN2LMNAKMT2APOLB |
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-108602823-A | As deubiquitinating enzymes（DUB）The spiral shell of inhibitor-condensation pyrrolidin derivatives | 特殊治疗有限公司 | 2018-09-28 | — | — | CN | disclosed |