Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 9/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Isoleucine SCHEMBL8483690 | 0.82 | CYP2C19 (0.53) | CTSCRAB9ACTSKCYP2C19SLC1A3 | |
| Isoleucine SCHEMBL8483685 | 0.82 | CYP2C19 (0.53) | CTSCRAB9ACTSKCYP2C19SLC1A3 | |
| SCHEMBL20543720 | 0.79 | CTSC (0.55) | CTSCRAB9ACYP2C19SLC1A3SLC1A2 | |
| SCHEMBL528155 | 0.79 | ALPI (0.50) | SLC1A3SLC1A2SLC1A1DPP4DPP8 | |
| SCHEMBL1537168 | 0.79 | ALPI (0.50) | SLC1A3SLC1A2SLC1A1DPP4DPP8 | |
| SCHEMBL1537466 | 0.79 | ALPI (0.50) | SLC1A3SLC1A2SLC1A1DPP4DPP8 | |
| Hydrochloric Acid SCHEMBL29780783 | 0.78 | CTSC (0.53) | CTSCRAB9ACYP2C19SLC1A3SLC1A2 | |
| SCHEMBL1631750 | 0.78 | CTSC (0.59) | CTSCRAB9ACYP2C19SLC1A3SLC1A2 | |
| SCHEMBL19699149 | 0.78 | CTSC (0.59) | CTSCRAB9ACYP2C19SLC1A3SLC1A2 | |
| SCHEMBL2058609 | 0.78 | CTSC (0.59) | CTSCRAB9ACYP2C19SLC1A3SLC1A2 |
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-5892038-A | ENZYME INHIBITORS FOR TREATMENT OF DISEASES SUCH AS MALARIA | PHARMACOPEIA, INC. (US) | 1999-04-06 | — | — | US | claimed |
| US-5734054-A | Hydroxy-amino acid amides | PHARMACOPEIA, INC. (US) | 1998-03-31 | — | — | US | disclosed |