Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | GUSB | P08236 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6122794 | 0.91 | ALDH1A1 (0.47) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2717092 | 0.86 | GNRHR (0.41) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2716683 | 0.86 | PIK3CD (0.46) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL6122682 | 0.84 | PIK3CD (0.48) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL6122848 | 0.83 | ALDH1A1 (0.44) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2718718 | 0.82 | PIK3CD (0.47) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2718336 | 0.79 | PIK3CD (0.48) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL6128776 | 0.78 | ALDH1A1 (0.41) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2719948 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HPGDPLA2G2APOLBMAPT | |
| SCHEMBL2718042 | 0.76 | PIK3CD (0.40) | ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2445900-A2 | POLYCYCLIC DERIVATIVES OF PYRIDINE AND THEIR USE IN THE TREATMENT OF (INTER ALIA) RHEUMATOID ARTHRITIS AND SIMILAR DISEASES | Amgen, Inc (US) | 2012-05-02 | — | — | EP | disclosed |
| WO-2010151740-A2 | HETEROCYCLIC COMPOUNDS AND THEIR USES | AMGEN INC. (US) | 2010-12-29 | — | — | WO | disclosed |