Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.57 |
| ▸ | GHSR | Q92847 | 10/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.46 |
| ▸ | CNKSR1 | Q969H4 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7538030 | 0.80 | PFKFB3 (0.59) | PFKFB3RXFP1KDM4EACLY | |
| SCHEMBL10067522 | 0.77 | NRP1 (0.50) | PFKFB3RXFP1CAPN1 | |
| SCHEMBL4569830 | 0.76 | NRP1 (0.49) | PFKFB3RXFP1CAPN1 | |
| SCHEMBL788488 | 0.76 | PFKFB3 (1.00) | PFKFB3RXFP1GHSRKDM4E | |
| SCHEMBL7531699 | 0.75 | ACLY (0.61) | ACLY | |
| SCHEMBL2835960 | 0.75 | PFKFB3 (0.60) | PFKFB3RXFP1GHSRKDM4ECNKSR1 | |
| SCHEMBL7799532 | 0.74 | PFKFB3 (0.70) | PFKFB3RXFP1GHSRKDM4ECNKSR1 | |
| SCHEMBL9930723 | 0.74 | CCR2 (0.57) | PFKFB3RXFP1GHSRKDM4E | |
| SCHEMBL29989250 | 0.73 | PFKFB3 (0.59) | PFKFB3RXFP1KDM4ECNKSR1HDAC3 | |
| SCHEMBL532975 | 0.73 | ACLY (0.69) | KDM4EACLY |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002028353-A2 | PHOSPHATE TRANSPORT INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-04-11 | — | — | WO | claimed |
| WO-2002028353-A2 | PHOSPHATE TRANSPORT INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-04-11 | — | — | WO | disclosed |