Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 4/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7460744 | 0.81 | CCR1 (0.53) | CCR1RAB9ACNR2HDAC3HDAC4 | |
| SCHEMBL24898028 | 0.80 | RAB9A (0.55) | CCR1RAB9ACNR2HDAC3HDAC4 | |
| SCHEMBL7459752 | 0.80 | PLK1 (0.51) | RAB9AHDAC8MEN1KMT2AANPEP | |
| SCHEMBL7687109 | 0.77 | CCR1 (0.48) | CCR1RAB9ACNR2ANPEP | |
| SCHEMBL29846528 | 0.76 | CCR1 (0.47) | CCR1RAB9ACNR2HDAC3HDAC4 | |
| SCHEMBL7466229 | 0.76 | PSMB5 (0.51) | RAB9ACNR2KMT2A | |
| SCHEMBL701904 | 0.74 | RAB9A (0.52) | CCR1RAB9ACNR2HDAC3HDAC4 | |
| SCHEMBL8256575 | 0.74 | PSMB5 (0.57) | CCR1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL2927792 | 0.74 | PSMB5 (0.57) | CCR1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL27482350 | 0.74 | EGLN1 (0.46) | CNR2HDAC3HDAC1HDAC2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0983228-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2002-08-07 | — | — | EP | claimed |
| EP-0983228-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-03-08 | — | — | EP | claimed |
| WO-1998050342-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-11-12 | — | — | WO | claimed |