Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.45 |
| ▸ | RAB9A | P51151 | 7/20 | 0.45 |
| ▸ | POLB | P06746 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8327705 | 0.86 | CTSS (0.53) | NPC1RAB9APOLBMEN1KMT2A | |
| SCHEMBL8337365 | 0.86 | CTSS (0.53) | NPC1RAB9APOLBMEN1KMT2A | |
| SCHEMBL8327841 | 0.83 | CTSS (0.41) | RAB9APOLBCA12CA1CA2 | |
| SCHEMBL13783463 | 0.77 | NPC1 (0.60) | NPC1RAB9APOLBTDP1MEN1 | |
| SCHEMBL8338028 | 0.77 | NPC1 (0.47) | NPC1RAB9APOLBMEN1KMT2A | |
| SCHEMBL1095329 | 0.76 | ROCK2 (0.42) | CA12CA1CA9 | |
| SCHEMBL1095328 | 0.76 | ROCK2 (0.42) | CA12CA1CA9 | |
| SCHEMBL31169451 | 0.75 | NPC1 (0.57) | NPC1RAB9APOLBTDP1MEN1 | |
| SCHEMBL8335661 | 0.74 | MEN1 (0.52) | NPC1RAB9APOLBMEN1KMT2A | |
| SCHEMBL1105000 | 0.73 | CTSS (0.49) | — |
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-2004022528-A2 | ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |