Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 5/20 | 0.44 |
| ▸ | CTSS | P25774 | 4/20 | 0.44 |
| ▸ | CTSL | P07711 | 4/20 | 0.44 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.39 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.39 |
| ▸ | CCR1 | P32246 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9011901 | 0.89 | CTSB (0.44) | CTSBCTSSCTSLCTSKCASP3 | |
| SCHEMBL9011708 | 0.88 | CTSB (0.44) | CTSBCTSSCTSLCTSKCASP3 | |
| SCHEMBL9011900 | 0.75 | CTSL (0.49) | CTSBCTSSCTSLCTSKCA2 | |
| SCHEMBL7275946 | 0.70 | CASP1 (0.47) | CTSBCTSSCTSLCTSKCASP3 | |
| SCHEMBL9364447 | 0.69 | LNPEP (0.40) | CTSBCTSSCTSLCTSKCYP3A4 | |
| SCHEMBL15130921 | 0.68 | CTSL (0.72) | CTSBCTSSCTSLCTSKCYP3A4 | |
| SCHEMBL9699796 | 0.68 | CTSK (0.41) | CTSBCTSSCTSLCTSKCYP3A4 | |
| SCHEMBL9364872 | 0.67 | NAAA (0.38) | CTSBCTSSCTSLCTSKCASP1 | |
| SCHEMBL3140640 | 0.67 | CTSL (0.55) | CTSBCTSSCTSLCTSKCASP3 | |
| Isopropylamine SCHEMBL10558459 | 0.67 | CTSL (0.59) | CTSBCTSSCTSLCTSKCASP3 |
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-5545750-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS | ABBOTT LABORATORIES (US) | 1996-08-13 | — | — | US | disclosed |