Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 1/20 | 0.48 |
| ▸ | CTSC | P53634 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7362451 | 1.00 | CYP2C19 (0.60) | CYP2C19RAB9AALDH1A1FOLH1CTSS | |
| SCHEMBL25721680 | 0.89 | RAB9A (0.54) | CYP2C19RAB9AALDH1A1CTSSCTSK | |
| SCHEMBL13350918 | 0.85 | RAB9A (0.50) | CYP2C19RAB9AALDH1A1CTSSCTSK | |
| SCHEMBL6661590 | 0.85 | RAB9A (0.50) | CYP2C19RAB9AALDH1A1CTSSCTSK | |
| SCHEMBL6661586 | 0.85 | RAB9A (0.50) | CYP2C19RAB9AALDH1A1CTSSCTSK | |
| SCHEMBL6918232 | 0.85 | CYP2C19 (0.57) | CYP2C19RAB9AALDH1A1FOLH1CTSS | |
| SCHEMBL13567542 | 0.84 | CYP2C19 (0.60) | CYP2C19RAB9AALDH1A1FOLH1CTSS | |
| SCHEMBL8188457 | 0.84 | CYP2C19 (0.64) | CYP2C19RAB9AALDH1A1FOLH1CTSS | |
| SCHEMBL14019361 | 0.84 | CYP2C19 (0.64) | CYP2C19RAB9AALDH1A1FOLH1CTSS | |
| SCHEMBL12329284 | 0.82 | CYP2C19 (0.58) | CYP2C19RAB9AALDH1A1FOLH1CTSS |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0746320-B1 | HIV PROTEASE INHIBITORS AND INTERMEDIATES | LILLY CO ELI (US) | 2001-01-31 | — | — | EP | disclosed |
| EP-0744948-A4 | PROTEASE INHIBITORS | LILLY CO ELI (US) | 1997-06-11 | — | — | EP | disclosed |
| EP-0746320-A4 | HIV PROTEASE INHIBITORS AND INTERMEDIATES | LILLY CO ELI (US) | 1997-06-11 | — | — | EP | disclosed |
| US-5624934-A | PREVENTING HIV INFECTION | ELI LILLY AND COMPANY (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0746320-A1 | HIV PROTEASE INHIBITORS AND INTERMEDIATES | ELI LILLY AND COMPANY (US) | 1996-12-11 | — | — | EP | disclosed |
| EP-0744948-A1 | PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 1996-12-04 | — | — | EP | disclosed |
| US-5480887-A | FOR HIV, THIENO(3,2-C)PYRIDINE-(6S)-CARBOXAMIDES | ELI LILLY AND COMPANY (US) | 1996-01-02 | — | — | US | disclosed |
| WO-1995020962-A1 | PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 1995-08-10 | — | — | WO | disclosed |
| WO-1995020965-A1 | HIV PROTEASE INHIBITORS AND INTERMEDIATES | ELI LILLY AND COMPANY (US) | 1995-08-10 | — | — | WO | disclosed |