Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 5/20 | 0.56 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.49 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | PPIB | P23284 | 1/20 | 0.43 |
| ▸ | PPIA | P62937 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL28002431 | 0.80 | PIN1 (0.66) | PIN1PPIBPPIATSHRHSD17B10 | |
| SCHEMBL25642142 | 0.78 | PIN1 (0.59) | PIN1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL27914888 | 0.78 | PIN1 (0.59) | PIN1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL27933389 | 0.78 | PIN1 (0.59) | PIN1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL30799429 | 0.78 | PIN1 (0.64) | PIN1CES2CES1RAB9AKMT2A | |
| SCHEMBL30799272 | 0.77 | PIN1 (0.60) | PIN1CES2CES1RAB9AMEN1 | |
| SCHEMBL30799232 | 0.77 | PIN1 (0.57) | PIN1PPIBPPIAHPGDALDH1A1 | |
| SCHEMBL27822635 | 0.75 | PIN1 (0.52) | PIN1RAB9AKDM4EALDH1A1MAPT | |
| SCHEMBL31280859 | 0.75 | CES2 (0.59) | CES2CES1RAB9AMEN1KMT2A | |
| SCHEMBL12733130 | 0.75 | PIN1 (0.77) | PIN1PPIBPPIA |
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 |