Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.70 |
| ▸ | NPC1 | O15118 | 2/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.47 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | WNT3A | P56704 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28456749 | 0.85 | SMN1; SMN2 (0.81) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL6488804 | 0.83 | SMN1; SMN2 (0.63) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL6202998 | 0.83 | RAB9A (1.00) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL9701760 | 0.82 | RAB9A (0.70) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL9521330 | 0.81 | SMN1; SMN2 (0.60) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL28950040 | 0.78 | RAB9A (0.88) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL11666172 | 0.77 | CNR1 (0.67) | RAB9ANPC1SMN1; SMN2CNR1KDM4E | |
| SCHEMBL10764739 | 0.76 | SMN1; SMN2 (1.00) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL5493166 | 0.75 | SMN1; SMN2 (0.56) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL20913158 | 0.74 | SMN1; SMN2 (0.52) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 |
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-1204636-A1 | 3-OXOPROPANE-1-SULPHONIC ACIDS AND SULPHONATES | DSM N.V. (NL) | 2002-05-15 | — | — | EP | disclosed |
| WO-2001014327-A1 | 3-OXOPROPANE-1-SULPHONIC ACIDS AND SULPHONATES | DSM N.V. (NL) | 2001-03-01 | — | — | WO | disclosed |