Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 11/20 | 0.70 |
| ▸ | PPIA | P62937 | 3/20 | 0.46 |
| ▸ | PPIB | P23284 | 2/20 | 0.46 |
| ▸ | PPID | Q08752 | 2/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.44 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.44 |
| ▸ | PPIL1 | Q9Y3C6 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28002344 | 0.81 | PIN1 (0.70) | PIN1PPIAPPIBPPIDTAS1R3 | |
| SCHEMBL12733130 | 0.79 | PIN1 (0.77) | PIN1PPIAPPIBPPIDTAS1R3 | |
| SCHEMBL28002431 | 0.78 | PIN1 (0.66) | PIN1PPIAPPIBPPIDHTT | |
| SCHEMBL30799232 | 0.78 | PIN1 (0.57) | PIN1PPIAPPIBPPIDTAS1R3 | |
| SCHEMBL4742598 | 0.76 | PIN1 (0.58) | PIN1TAS1R3TAS1R1TAS1R2KCNQ2 | |
| SCHEMBL8848989 | 0.76 | PIN1 (0.58) | PIN1TAS1R3TAS1R1TAS1R2KCNQ2 | |
| SCHEMBL4830828 | 0.76 | PIN1 (0.62) | PIN1KCNQ2 | |
| SCHEMBL5969897 | 0.75 | TAS1R3 (0.64) | TAS1R3TAS1R1TAS1R2ALDH1A1 | |
| SCHEMBL27914923 | 0.75 | PIN1 (0.57) | PIN1PPIAPPIBPPIDTAS1R3 | |
| SCHEMBL2790690 | 0.74 | PIN1 (0.60) | PIN1HTTKCNQ2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115894141-B | Method for synthesizing acyl indene alkane derivative | 贺州学院 | 2023-12-22 | — | — | CN | disclosed |