Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8613529 | 1.00 | HPGD (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8616688 | 1.00 | HPGD (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8621478 | 1.00 | HPGD (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8615172 | 1.00 | HPGD (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL9036946 | 1.00 | HPGD (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8619539 | 0.99 | HPGD (0.59) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8616296 | 0.96 | HPGD (0.57) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8619397 | 0.96 | HPGD (0.57) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8615235 | 0.93 | EPHX2 (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL8615231 | 0.93 | EPHX2 (0.58) | HPGDCYP1A2CYP2C19ALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-5767121-A | ANTIINFLAMMATORY AND -ARTHRITIC AGENTS; ANTIPYRETICS; ANALGESICS; ADHESION PROTEIN EXPRESSION AND CYCLOXYGENASE AND 5-LIPOXYGENASE INHIBITORS; IMMUNOSUPPRESSANTS AND -MODULATORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-06-16 | — | — | US | disclosed |