Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 8/20 | 0.70 |
| ▸ | CTSL | P07711 | 6/20 | 0.70 |
| ▸ | CTSS | P25774 | 6/20 | 0.70 |
| ▸ | CTSB | P07858 | 5/20 | 0.70 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.52 |
| ▸ | ELANE | P08246 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP8 | P22894 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6311475 | 1.00 | CTSK (0.70) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL6782182 | 1.00 | CTSK (0.70) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL5325864 | 0.87 | CTSK (0.66) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL1059174 | 0.87 | CTSK (0.66) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL1643093 | 0.87 | CTSK (0.66) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL20298626 | 0.86 | CTSK (0.65) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL20323002 | 0.86 | MEN1 (0.69) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL20298625 | 0.86 | CTSK (0.65) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL15130921 | 0.86 | CTSL (0.72) | CTSKCTSLCTSSCTSBMEN1 | |
| SCHEMBL10266101 | 0.85 | CTSL (0.64) | CTSKCTSLCTSSCTSBMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013012918-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS INC. (US) | 2013-01-24 | — | — | WO | disclosed |
| EP-1826199-A1 | Modified amino acids | Technische Universität Wien (AT) | 2007-08-29 | — | — | EP | disclosed |
| EP-1826199-A1 | Modified amino acids | Technische Universität Wien (AT) | 2007-08-29 | — | — | EP | disclosed |