Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 2/20 | 0.47 |
| ▸ | GABBR2 | O75899 | 4/20 | 0.46 |
| ▸ | GABBR1 | Q9UBS5 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11216181 | 0.85 | PTPN1 (0.50) | SRCMAPK1ALDH1A1LMNACYP2C9 | |
| SCHEMBL11211519 | 0.82 | SRC (0.69) | SRCCYP3A4ALDH1A1LMNATSHR | |
| SCHEMBL11211392 | 0.82 | SRC (0.48) | SRCGABBR2GABBR1CYP3A4MAPK1 | |
| SCHEMBL11842507 | 0.81 | SRC (0.62) | SRCGABBR2GABBR1BRD4CYP2C9 | |
| SCHEMBL11218064 | 0.81 | SRC (0.47) | SRCMAPK1ALDH1A1LMNACYP2D6 | |
| SCHEMBL11212252 | 0.81 | SRC (0.47) | SRCHDAC4HDAC7HDAC5ALDH1A1 | |
| SCHEMBL11212879 | 0.81 | SRC (0.47) | SRCGABBR2GABBR1CYP3A4BRD4 | |
| SCHEMBL13619014 | 0.80 | SRC (0.70) | SRCALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL9706850 | 0.80 | SRC (0.70) | SRCALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL11218212 | 0.77 | ALOX5 (0.49) | SRCNPC1MAPK1ALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4329454-A | Cephalosporin compounds | ELI LILLY AND COMPANY (US) | 1982-05-11 | — | — | US | disclosed |