Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | RPA1 | P27694 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.40 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.40 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.40 |
| ▸ | ICMT | O60725 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL869116 | 0.83 | CA2 (0.65) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL21090110 | 0.83 | PIK3CA (0.58) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL3396522 | 0.81 | PIK3CA (0.56) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL27835202 | 0.81 | PIK3CA (0.56) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL1699595 | 0.81 | PIK3CA (0.56) | PIK3CACA2RPA1HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL5408486 | 0.80 | PIK3CA (0.55) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL28638604 | 0.80 | PIK3CA (0.55) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL23869399 | 0.79 | PIK3CA (0.54) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL2791406 | 0.79 | PIK3CA (0.54) | PIK3CACA2RPA1HDAC3HDAC1 | |
| SCHEMBL2791411 | 0.79 | PIK3CA (0.54) | PIK3CACA2RPA1HDAC3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4175125-A | USING HALOGENATED PHENYLTHIOACETAMIDO CEPHALOSPORANIC ACID DERIVAT | ELI LILLY AND COMPANY (US) | 1979-11-20 | — | — | US | disclosed |
| US-4056676-A | ANTIBIOTIC | ELI LILLY AND COMPANY (US) | 1977-11-01 | — | — | US | disclosed |