Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TIMP3 | P35625 | 4/20 | 0.52 |
| ▸ | CD40 | P25942 | 4/20 | 0.49 |
| ▸ | CD40LG | P29965 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.42 |
| ▸ | ENTPD3 | O75355 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | TDP2 | O95551 | 1/20 | 0.42 |
| ▸ | CBX7 | O95931 | 1/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10908486 | 0.95 | TIMP3 (0.55) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL11338986 | 0.93 | TIMP3 (0.60) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10907629 | 0.91 | TIMP3 (0.52) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10907699 | 0.88 | RECQL (0.59) | TIMP3MEN1KMT2AUSP2RECQL | |
| SCHEMBL11338955 | 0.88 | TIMP3 (0.64) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10909141 | 0.87 | CD40 (0.52) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10907664 | 0.87 | CD40 (0.50) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL11433078 | 0.87 | AURKB (0.52) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10908823 | 0.86 | TIMP3 (0.52) | TIMP3CD40CD40LGMEN1KMT2A | |
| SCHEMBL10907808 | 0.84 | RECQL (0.62) | TIMP3MEN1KMT2AUSP2RECQL |
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 |
|---|---|---|---|---|---|---|---|
| US-4599204-A | Oxalylamides useful as dental antiplaque agents and inhibitors of connective tissue destruction | AMERICAN CYANAMID COMPANY (US) | 1986-07-08 | — | — | US | disclosed |