Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 3/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 2/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | GAK | O14976 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19805097 | 0.83 | PRKCI (0.48) | LIMK1PRKCIPIK3CASMN1; SMN2NPY5R | |
| SCHEMBL19805185 | 0.68 | PRKCI (0.48) | LIMK1PRKCIPIK3CAALDH1A1NPY5R | |
| SCHEMBL19805096 | 0.68 | PRKCI (0.48) | LIMK1PRKCIPIK3CANPY5R | |
| SCHEMBL19805137 | 0.65 | HTR2C (0.62) | LIMK1PRKCIPIK3CAALDH1A1KDM4E | |
| SCHEMBL19805169 | 0.65 | PRKCI (0.46) | LIMK1PRKCIPIK3CANPC1RAB9A | |
| SCHEMBL19805168 | 0.65 | PRKCI (0.44) | LIMK1PRKCIPIK3CAALDH1A1KDM4E | |
| SCHEMBL29464967 | 0.59 | KMT2A (0.53) | PRKCQPRKCD | |
| SCHEMBL1321733 | 0.59 | PRKCI (0.52) | PRKCIALDH1A1SMN1; SMN2NPY5RKDM4E | |
| SCHEMBL19805093 | 0.58 | LIMK1 (0.53) | LIMK1NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL4892520 | 0.58 | LIMK1 (0.72) | LIMK1NPC1RAB9AALDH1A1SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018017874-A1 | INHIBITORS OF MICROBIAL BETA-GLUCURONIDASE ENZYMES AND USES THEREOF | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2018-01-25 | — | — | WO | disclosed |