Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | FABP7 | O15540 | 1/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16214740 | 0.90 | TSHR (0.44) | GAAPKMGLABACE1TSHR | |
| SCHEMBL1812580 | 0.79 | OPRK1 (0.48) | GAATSHRHPGDNPC1RAB9A | |
| SCHEMBL6120052 | 0.75 | SMN1; SMN2 (0.46) | GAAPKMBACE1TSHRHPGD | |
| SCHEMBL15457715 | 0.74 | SLC6A2 (0.45) | GAAPKMTSHRHPGDL3MBTL1 | |
| SCHEMBL30148934 | 0.74 | ALDH1A1 (0.46) | GAAPKMBACE1TSHRHPGD | |
| SCHEMBL3617827 | 0.74 | SLC6A2 (0.45) | GAAPKMTSHRHPGDL3MBTL1 | |
| SCHEMBL30148856 | 0.73 | TSHR (0.47) | GAAPKMTSHRHPGDL3MBTL1 | |
| SCHEMBL11963583 | 0.72 | TSHR (0.44) | GAAPKMBACE1TSHRHPGD | |
| SCHEMBL850188 | 0.72 | FABP7 (0.50) | GAAPKMTSHRHPGDDDB1 | |
| SCHEMBL1668432 | 0.72 | SMN1; SMN2 (0.43) | GAAPKMBACE1TSHRHPGD |
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-2486034-A1 | SPIROCYCLIC COMPOUNDS AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Bristol-Myers Squibb Company (US) | 2012-08-15 | — | — | EP | disclosed |
| WO-2011044197-A1 | SPIROCYCLIC COMPOUNDS AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-04-14 | — | — | WO | disclosed |