Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.79 |
| ▸ | DDX3X | O00571 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 6/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.51 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.50 |
| ▸ | SCD | O00767 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3766427 | 0.88 | AKR1C3 (1.00) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL13058905 | 0.87 | AKR1C3 (0.79) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL29624703 | 0.86 | AKR1C3 (0.77) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL20096686 | 0.86 | AKR1C3 (0.77) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL20096879 | 0.85 | AKR1C3 (0.75) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL22703577 | 0.84 | AKR1C3 (0.73) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL13002087 | 0.84 | AKR1C3 (0.73) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL1999901 | 0.79 | AKR1C3 (0.63) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL239690 | 0.76 | MEN1 (0.75) | AKR1C3DDX3XNPC1RAB9AMEN1 | |
| SCHEMBL30020996 | 0.76 | MEN1 (0.75) | AKR1C3DDX3XNPC1RAB9AMEN1 |
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-2013032527-A1 | LLP2A-BISPHOSPHONATE CONJUGATES FOR OSTEOPOROSIS TREATMENT | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2013-03-07 | — | — | WO | disclosed |
| WO-2012031228-A2 | LLP2A-BISPHOSPHONATE CONJUGATES FOR OSTEOPOROSIS TREATMENT | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2012-03-08 | — | — | WO | disclosed |
| WO-2008031016-A2 | HETEROCYCLIC LIGANDS FOR INTEGRIN IMAGING AND THERAPY | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2008-03-13 | — | — | WO | disclosed |