Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VIPR2 | P41587 | 14/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | TACR2 | P21452 | 1/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.43 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.43 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7329719 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL7329727 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL6366453 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL29624083 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL6366449 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL7336675 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL6366451 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL7362961 | 0.95 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL7339334 | 0.94 | VIPR2 (0.51) | VIPR2MMP1MMP2MMP9MMP8 | |
| SCHEMBL7330086 | 0.94 | VIPR2 (0.48) | VIPR2MMP1MMP2MMP9MMP8 |
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-0434365-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | claimed |
| EP-0434365-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | disclosed |