Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CHKA | P35790 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | P2RX4 | Q99571 | 3/20 | 0.41 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL27586848 | 0.79 | CA2 (0.54) | CA2CHKAHPGDPOLB | |
| SCHEMBL27524148 | 0.78 | LIPE (0.38) | ALDH1A1USP2P2RX4P2RX1P2RX3 | |
| SCHEMBL413020 | 0.74 | ALDH1A1 (0.87) | ALDH1A1CA2CHKAUSP2HPGD | |
| SCHEMBL3954333 | 0.74 | ALDH1A1 (0.87) | ALDH1A1CA2CHKAUSP2HPGD | |
| SCHEMBL525220 | 0.74 | FBP1 (0.38) | — | |
| SCHEMBL7126113 | 0.74 | FBP1 (0.38) | — | |
| SCHEMBL3948084 | 0.72 | ALDH1A1 (0.93) | ALDH1A1CA2CHKAUSP2HPGD | |
| SCHEMBL3947402 | 0.72 | ALDH1A1 (0.93) | ALDH1A1CA2CHKAUSP2HPGD | |
| SCHEMBL3948691 | 0.72 | ALDH1A1 (0.88) | ALDH1A1CA2CHKAUSP2HPGD | |
| SCHEMBL3948090 | 0.72 | ALDH1A1 (0.93) | ALDH1A1CA2CHKAUSP2HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1732566-A2 | 6-AZAINDOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005097129-A2 | 6-AZAINDOLE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-10-20 | — | — | WO | disclosed |
| US-3997533-A | Process for the preparation of 7-acylamino-desacetoxycephalosporanic derivatives | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-14 | — | — | US | disclosed |
| US-3936447-A | 7-Acylamino-desacetoxy-cephalosporanic acid esters and their production | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-03 | — | — | US | disclosed |