Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.39 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL15474240 | 0.90 | TSHR (0.44) | TSHRNAAAIDO1MAOBMAP3K7 | |
| SCHEMBL10315968 | 0.90 | TSHR (0.44) | TSHRNAAAIDO1MAOBMAP3K7 | |
| SCHEMBL460594 | 0.83 | TSHR (0.47) | TSHRNAAAIDO1AGXTLTA4H | |
| SCHEMBL8326540 | 0.82 | TSHR (0.50) | TSHRNAAAIDO1MAOBMAP3K7 | |
| SCHEMBL10315965 | 0.82 | TSHR (0.50) | TSHRNAAAIDO1MAOBMAP3K7 | |
| SCHEMBL18660678 | 0.77 | TSHR (0.52) | TSHRNAAAIDO1MAOBAGXT | |
| SCHEMBL265425 | 0.77 | TSHR (0.52) | TSHRNAAAIDO1AGXTLTA4H | |
| SCHEMBL7794029 | 0.77 | TSHR (0.52) | TSHRNAAAIDO1MAOBAGXT | |
| SCHEMBL3438765 | 0.77 | TSHR (0.52) | TSHRNAAAIDO1AGXTLTA4H | |
| SCHEMBL27661883 | 0.77 | TSHR (0.52) | TSHRNAAAIDO1AGXTLTA4H |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1305280-A2 | PROCESS FOR MAKING 3-HYDROXYALKANENITRILES AND HYDROXYAMINOALKANES | E. I. du Pont de Nemours and Company (US) | 2003-05-02 | — | — | EP | disclosed |
| US-6384263-B1 | Process for making 3-hydroxyalkanelnitriles and conversion of the 3-hydroxyalkanelnitrile to an hydroxyaminoalkane | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-05-07 | — | — | US | disclosed |
| US-20020022737-A1 | Process for making 3-hydroxyalkanelnitriles and conversion of the 3-hydroxyalkanelnitrile to an hydroxyaminoalkane | INV NYLON CHEMICALS AMERICAS, LLC | 2002-02-21 | — | — | US | disclosed |
| WO-2002012173-A2 | PROCESS FOR MAKING 3-HYDROXYALKANENITRILES AND HYDROXYAMINOALKANES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2002-02-14 | — | — | WO | disclosed |