Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 10/20 | 0.49 |
| ▸ | MERTK | Q12866 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.42 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28734428 | 0.90 | PIN1 (0.43) | PIN1MERTKNPC1DCTPP1RAB9A | |
| SCHEMBL3787500 | 0.84 | MERTK (0.59) | MERTKNPC1DCTPP1TXNRD1ALDH1A1 | |
| SCHEMBL1560939 | 0.83 | PIN1 (0.38) | PIN1MERTKDCTPP1KMT2AALDH1A1 | |
| SCHEMBL30461993 | 0.80 | LMNA (0.44) | KMT2AALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11749778 | 0.76 | PIN1 (0.45) | PIN1ALDH1A1 | |
| SCHEMBL18757880 | 0.76 | NPC1 (0.62) | PIN1NPC1RAB9AKMT2APRKCQ | |
| SCHEMBL4077793 | 0.75 | PIN1 (0.47) | PIN1ALDH1A1 | |
| SCHEMBL25381487 | 0.75 | LMNA (0.47) | NPC1DCTPP1RAB9AKMT2AALDH1A1 | |
| SCHEMBL1806718 | 0.75 | PIN1 (0.77) | PIN1MERTKALDH1A1LMNA | |
| SCHEMBL29388790 | 0.74 | PIK3CA (0.40) | NPC1DCTPP1RAB9AKMT2AALDH1A1 |
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-116693458-A | Cycloalkyl or heterocyclyl substituted heteroaryl compounds, compositions and uses thereof | 深圳市塔吉瑞生物医药有限公司 | 2023-09-05 | — | — | CN | disclosed |