Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | F3 | P13726 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8865614 | 1.00 | GSK3B (0.50) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL8419202 | 0.85 | MAPT (0.50) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL285248 | 0.85 | MAPT (0.50) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL6659979 | 0.85 | MAPT (0.50) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL8865510 | 0.84 | NPC1 (0.48) | MAPTALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL8865503 | 0.84 | NPC1 (0.48) | MAPTALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL6654014 | 0.83 | GSK3B (0.51) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL6654010 | 0.83 | GSK3B (0.51) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL8153624 | 0.82 | NPC1 (0.59) | GSK3BTHRBATMMAPTALDH1A1 | |
| SCHEMBL8864851 | 0.82 | CYP3A4 (0.47) | ALDH1A1AKR1C3NPC1RAB9ACYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5646313-A | PREPARING ENKEPHALINASE INHIBITORS | SOCIETE CIVILE BIOPROJET (FR) | 1997-07-08 | — | — | US | disclosed |
| US-5612371-A | ENZYME INHIBITORS | SOCIETE CIVILE BIOPROJECT (FR) | 1997-03-18 | — | — | US | disclosed |