Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9451547 | 0.85 | LCK (0.39) | ALK | |
| SCHEMBL9451696 | 0.82 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL9451550 | 0.68 | LCK (0.38) | SMN1; SMN2ALDH1A1HPGDKDM4E | |
| SCHEMBL27593194 | 0.65 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL1335315 | 0.64 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL7878824 | 0.64 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL6896283 | 0.64 | SMN1; SMN2 (0.57) | SMN1; SMN2ALDH1A1HPGDMAPTTP53 | |
| SCHEMBL18623608 | 0.63 | LMNA (0.69) | SMN1; SMN2ALDH1A1CYP3A4TP53LMNA | |
| SCHEMBL1366483 | 0.63 | PDGFRB (0.57) | SMN1; SMN2ALDH1A1HPGDPDGFRBEGFR | |
| Benzene SCHEMBL14840511 | 0.63 | POLB (0.39) | SMN1; SMN2TP53L3MBTL1LMNAKDM4E |
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-0567223-A1 | Glutamic acid derivatives as antineoplastic agents | ELI LILLY AND COMPANY (US) | 1993-10-27 | — | — | EP | disclosed |
| US-5196424-A | Antitumor | ELI LILLY AND COMPANY (US) | 1993-03-23 | — | — | US | disclosed |