Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC1 | P33527 | 2/20 | 0.76 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | NAMPT | P43490 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.58 |
| ▸ | PLAU | P00749 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL30873016 | 0.92 | MEN1 (0.70) | ABCC1ABCB1MEN1KMT2ANAMPT | |
| SCHEMBL7147243 | 0.92 | MEN1 (0.70) | ABCC1ABCB1MEN1KMT2ANAMPT | |
| SCHEMBL3245372 | 0.86 | NAMPT (0.65) | ABCC1MEN1KMT2ANAMPTPDE4D | |
| SCHEMBL18007344 | 0.85 | HPSE (0.66) | ABCC1MEN1KMT2AHDAC1HDAC8 | |
| SCHEMBL18007317 | 0.85 | ABCC1 (0.63) | ABCC1MEN1KMT2AHDAC1HDAC8 | |
| SCHEMBL16129641 | 0.85 | MEN1 (0.66) | ABCC1ABCB1MEN1KMT2AHDAC1 | |
| SCHEMBL18007313 | 0.84 | PTPN1 (0.63) | ABCC1MEN1KMT2AHDAC1HDAC8 | |
| SCHEMBL5724139 | 0.83 | NAMPT (0.66) | ABCC1MEN1KMT2ANAMPTALDH1A1 | |
| SCHEMBL16098533 | 0.81 | ALDH1A1 (0.86) | ABCB1MEN1KMT2ACYP3A4POLB | |
| SCHEMBL18007302 | 0.80 | MEN1 (0.65) | ABCC1MEN1KMT2AHDAC8POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1001766-B1 | COMPOUNDS FOR THE TREATMENT OF CCR5-MEDIATED DISEASES | SMITHKLINE BEECHAM CORP (US) | 2003-04-09 | — | — | EP | disclosed |
| US-6515027-B1 | Ligands, agonists or antagonists, of the CC chemokine receptor CC-CKR5 | SMITHKLINE BEECHAM CORP. | 2003-02-04 | — | — | US | disclosed |