Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5526532 | 0.99 | PKM (0.53) | PKMSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL5530718 | 0.81 | DPP7 (0.55) | PKMSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL7046489 | 0.79 | ALDH1A1 (0.56) | PKMSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL5521695 | 0.76 | HTT (0.47) | PKMKDM4EALDH1A1CYP2C19TSHR | |
| Lithium Ion SCHEMBL5526530 | 0.75 | ALDH1A1 (0.54) | PKMSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL5523635 | 0.74 | PKM (0.48) | PKMSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL5530343 | 0.73 | POLB (0.50) | PKMSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL5530337 | 0.73 | CTSS (0.56) | SMN1; SMN2KDM4EALDH1A1CYP2C19NPSR1 | |
| SCHEMBL16026437 | 0.71 | ALDH1A1 (0.83) | PKMSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL5520636 | 0.71 | L3MBTL1 (0.51) | SMN1; SMN2KDM4EALDH1A1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1452522-A2 | Novel compounds and compositions as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2004-09-01 | — | — | EP | disclosed |