Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | SLC9A1 | P19634 | 4/20 | 0.55 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14102741 | 0.77 | SLC9A1 (0.50) | KCNMA1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL3552907 | 0.76 | KCNMA1 (0.67) | KCNMA1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL9303187 | 0.76 | KCNMA1 (0.67) | KCNMA1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL16879473 | 0.75 | GRM2 (0.55) | KCNMA1TSHRSLC9A1GRM2GLA | |
| SCHEMBL9302790 | 0.74 | HPGD (1.00) | KCNMA1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL285179 | 0.74 | TSHR (0.70) | KCNMA1TSHRHPGDSLC9A1GRM2 | |
| SCHEMBL30360007 | 0.74 | TSHR (0.70) | KCNMA1TSHRHPGDSLC9A1GRM2 | |
| SCHEMBL22561764 | 0.73 | GRM2 (0.52) | KCNMA1TSHRLMNAKMT2ASLC9A1 | |
| SCHEMBL3878065 | 0.73 | KCNMA1 (0.80) | KCNMA1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL2734889 | 0.72 | GRM2 (1.00) | KCNMA1ALDH1A1SLC9A1GRM2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2524917-A1 | FUSED PYRIDINE DERIVATIVES | Xuanzhu Pharmaco., Ltd. (CN) | 2012-11-21 | — | — | EP | disclosed |