Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.61 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9529506 | 0.90 | BCHE (0.66) | BCHESLC18A2SLC6A2SLC6A4ATM | |
| SCHEMBL19465402 | 0.89 | BCHE (0.49) | BCHESLC18A2SLC6A2SLC6A4ATM | |
| SCHEMBL3247871 | 0.84 | ATM (0.58) | BCHESLC18A2ATMNPSR1SIGMAR1 | |
| SCHEMBL7990233 | 0.83 | SLC6A4 (0.60) | BCHESLC18A2SLC6A2SLC6A4 | |
| SCHEMBL1733071 | 0.83 | CEL (0.51) | BCHESLC18A2SLC6A4NPSR1SIGMAR1 | |
| SCHEMBL28926014 | 0.82 | CYP2D6 (0.58) | BCHESLC18A2ATMNPSR1SIGMAR1 | |
| SCHEMBL1732699 | 0.80 | CEL (0.46) | BCHESLC18A2SLC6A4NPSR1 | |
| SCHEMBL9130932 | 0.76 | MTNR1A (0.56) | BCHE | |
| SCHEMBL1581739 | 0.76 | SLC18A2 (0.49) | SLC18A2SLC6A2SLC6A4 | |
| SCHEMBL7882632 | 0.76 | KCNA5 (0.56) | BCHESLC18A2SLC6A2SLC6A4ATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE35886-E | ENDOTHELIN-CONVERTING ENZYME INHIBITOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-01 | — | — | US | claimed |
| EP-1611130-A2 | REVERSE-TURN MIMETICS AND METHOD RELATING THERETO | Choongwae Pharma Corporation (KR) | 2006-01-04 | — | — | EP | disclosed |
| WO-2004093828-A2 | REVERSE-TURN MIMETICS AND METHOD RELATING THERETO | CHOONGWAE PHARMA CORPORATION (KR) | 2004-11-04 | — | — | WO | disclosed |