Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 1/20 | 0.58 |
| ▸ | CTNNB1 | P35222 | 7/20 | 0.57 |
| ▸ | WNT3A | P56704 | 7/20 | 0.57 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.53 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1182701 | 0.85 | PRKCI (0.57) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL6181845 | 0.85 | PRKCI (0.57) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL1091802 | 0.85 | ATM (0.69) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL4260152 | 0.83 | PKM (0.70) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL11022828 | 0.83 | HPGD (0.70) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL15088740 | 0.83 | CTNNB1 (0.60) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL11022359 | 0.82 | PRKCI (0.66) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL1395976 | 0.81 | PRKCI (0.64) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 | |
| SCHEMBL4831672 | 0.81 | ATM (0.72) | CTNNB1WNT3ARAB9ANPC1ATM | |
| SCHEMBL29503137 | 0.81 | PRKCI (0.69) | PRKCICTNNB1WNT3ATAS1R3TAS1R1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104177241-B | Alkynyl diketone compound and synthetic method thereof | 华东师范大学 | 2017-01-11 | — | — | CN | disclosed |
| CN-104177241-A | Alkynyl diketone compound and synthetic method thereof | UNIV EAST CHINA NORMAL | 2014-12-03 | — | — | CN | disclosed |
| WO-2008126106-A2 | NOVEL AND IMPROVED PROCESSES FOR THE PREPARATION OF INTERMEDIATES OF DARIFENACIN, DARIFENACIN AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS | SATYANARAYANA REDDY MANNE (IN) | 2008-10-23 | — | — | WO | disclosed |