Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | AGXT | P21549 | 2/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6528481 | 0.82 | HTR1B (0.43) | IDO1AGXTTAAR1SIGMAR1MAOB | |
| SCHEMBL6531584 | 0.79 | MAPK1 (0.35) | SMN1; SMN2TP53IDO1LMNATAAR1 | |
| SCHEMBL8583956 | 0.75 | G6PC1 (0.52) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL11049508 | 0.72 | LTA4H (0.47) | ALDH1A1SMN1; SMN2IDO1LMNALTA4H | |
| SCHEMBL31629417 | 0.72 | APP (0.46) | SMN1; SMN2TP53TSHRIDO1LMNA | |
| SCHEMBL1930129 | 0.70 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL190915 | 0.69 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL11202432 | 0.69 | IDO1 (0.43) | IDO1AGXTTAAR1SIGMAR1MAOB | |
| SCHEMBL244069 | 0.67 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL11437812 | 0.67 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 |
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-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |