Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.41 |
| ▸ | GABRE | P78334 | 1/20 | 0.41 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.41 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.41 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.41 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2549215 | 0.77 | CCNT1 (0.39) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29954886 | 0.77 | CCNT1 (0.39) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29953488 | 0.76 | CCNT1 (0.38) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29957318 | 0.76 | PARP1 (0.40) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL16044258 | 0.76 | CYP2A6 (0.51) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29956035 | 0.76 | CCNT1 (0.38) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL7867182 | 0.75 | KMT2A (0.47) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL23726002 | 0.72 | CCNT1 (0.35) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29955938 | 0.72 | ALDH1A1 (0.55) | CCNT1CDK9HASPINCYP2A6IMPDH2 | |
| SCHEMBL29951877 | 0.72 | PLG (0.39) | GABRPGABRDGABRA1GABRB1GABRG2 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |