Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 4/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.47 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | XIAP | P98170 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | LAP3 | P28838 | 2/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.45 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.45 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.45 |
| ▸ | CTSC | P53634 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | PAM | P19021 | 1/20 | 0.44 |
| ▸ | REN | P00797 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3805270 | 0.88 | SLC15A1 (0.47) | CTRB1CSNK1EALPIPKMPTGS1 | |
| SCHEMBL13535103 | 0.86 | SLC15A1 (0.44) | CTRB1CSNK1EALPIPKMPTGS1 | |
| SCHEMBL3742163 | 0.82 | SLC7A5 (0.44) | SLC7A5LAP3SLC15A1LTA4HREN | |
| SCHEMBL8909987 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL31506428 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL8910000 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL5541452 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL2059435 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL22305235 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 | |
| SCHEMBL7347831 | 0.82 | ATM (0.61) | CTSSCTSKCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0672649-B1 | Process for producing optically active diaminohexanone derivative | TAKASAGO PERFUMERY CO LTD (JP) | 1997-09-17 | — | — | EP | disclosed |
| US-5523458-A | HYDROGENATION OF (2S)-2,5-DIAMINO-1,6-DIPHENYL-4-HEXENE-3-ONE USING TRANSITION METAL COMPOUNDS AS CATALYSTS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1996-06-04 | — | — | US | disclosed |
| EP-0672649-A1 | Process for producing optically active diaminohexanone derivative | Takasago International Corporation (JP) | 1995-09-20 | — | — | EP | disclosed |