Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FPR2 | P25090 | 1/20 | 0.53 |
| ▸ | CTSK | P43235 | 5/20 | 0.49 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 2/20 | 0.45 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7421358 | 0.91 | FPR2 (0.51) | FPR2CTSKAAK1ATMCTSL | |
| SCHEMBL7466082 | 0.87 | AAK1 (0.61) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL14923445 | 0.87 | AAK1 (0.61) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL7466643 | 0.87 | AAK1 (0.61) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL7451931 | 0.87 | TACR1 (0.53) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL3346730 | 0.87 | TACR1 (0.53) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL7417030 | 0.87 | TACR1 (0.53) | CTSKAAK1ATMCTSLCTSS | |
| SCHEMBL7414757 | 0.83 | ATM (0.58) | FPR2CTSKAAK1ATMCTSL | |
| SCHEMBL15707033 | 0.82 | MAPT (0.50) | AAK1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL17183193 | 0.82 | MAPT (0.50) | AAK1HDAC3HDAC4HDAC1HDAC7 |
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-5733882-A | Retroviral protease inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1998-03-31 | — | — | US | disclosed |
| WO-1993002057-A1 | RETROVIRAL PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-02-04 | — | — | WO | disclosed |