Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 10/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 10/20 | 0.59 |
| ▸ | MAPT | P10636 | 10/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | HTT | P42858 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NPY1R | P25929 | 1/20 | 0.53 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.51 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6723621 | 0.93 | MEN1 (0.57) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6715689 | 0.93 | MAPT (0.59) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6718734 | 0.92 | MAPT (0.61) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6715739 | 0.89 | MEN1 (0.56) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6715664 | 0.89 | MEN1 (0.56) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL8347861 | 0.89 | MEN1 (0.56) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6723442 | 0.89 | MEN1 (0.58) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6714416 | 0.89 | ALDH1A1 (0.62) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6715692 | 0.89 | MEN1 (0.55) | MEN1KMT2AMAPTALDH1A1TP53 | |
| SCHEMBL6715481 | 0.88 | ALDH1A1 (0.56) | MEN1KMT2AMAPTALDH1A1TP53 |
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-2004022534-A1 | ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |