Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | PFKFB3 | Q16875 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL7997879 | 0.91 | MAPK9 (0.44) | CCKBRALDH1A1POLBSMN1; SMN2MAPT | |
| SCHEMBL12334602 | 0.80 | CCKBR (0.52) | CCKBRALDH1A1POLBMAPTMEN1 | |
| SCHEMBL12334072 | 0.79 | CCKBR (0.60) | CCKBRALDH1A1POLBMAPTMEN1 | |
| SCHEMBL9997173 | 0.79 | CCKBR (0.54) | CCKBRALDH1A1PFKFB3POLBMEN1 | |
| SCHEMBL12334073 | 0.78 | CCKBR (0.49) | CCKBRMAPTMEN1KMT2AHPGD | |
| SCHEMBL8007621 | 0.76 | TYMS (0.52) | ALDH1A1PFKFB3POLBSMN1; SMN2MAPT | |
| SCHEMBL15079960 | 0.76 | CCKBR (0.51) | CCKBRALDH1A1PFKFB3POLBSMN1; SMN2 | |
| SCHEMBL12334053 | 0.75 | NR1H3 (0.54) | CCKBRMAPTMEN1KMT2AHPGD | |
| SCHEMBL7460244 | 0.75 | CCKBR (0.50) | CCKBRPOLBSMN1; SMN2MAPTMEN1 | |
| SCHEMBL8033818 | 0.74 | HPGD (0.54) | CCKBRALDH1A1POLBMAPTMEN1 |
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-2000035904-A1 | INHIBITORS OF β-LACTAMASES AND USES THEREFOR | NORTHWESTERN UNIVERSITY (US) | 2000-06-22 | — | — | WO | disclosed |