Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9099468 | 0.79 | ALDH1A1 (0.51) | ALDH1A1TSHRKDM4ESMN1; SMN2NQO1 | |
| SCHEMBL151367 | 0.76 | KCNA3 (0.43) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL22015434 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP2C19GAAKDM4E | |
| SCHEMBL11132256 | 0.73 | GAA (0.54) | ALDH1A1TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10499396 | 0.73 | MLYCD (0.41) | ALDH1A1GAASMN1; SMN2MAPTLMNA | |
| SCHEMBL10498896 | 0.72 | BCL9 (0.42) | ALDH1A1GAAKDM4ESMN1; SMN2MAPT | |
| SCHEMBL25455157 | 0.72 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10499666 | 0.71 | MLYCD (0.39) | ALDH1A1KDM4ESMN1; SMN2MAPTMEN1 | |
| SCHEMBL7502123 | 0.71 | MEN1 (0.36) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL19002846 | 0.71 | NQO1 (0.56) | ALDH1A1TSHRCYP3A4CYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0474431-B1 | Amphiphilic compounds for sequential monolayer deposition | ICI PLC (GB) | 1996-03-06 | — | — | EP | disclosed |
| US-5275924-A | Non-centrosymmetric; hydrophobic; chromophores | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-01-04 | — | — | US | disclosed |
| EP-0474431-A1 | Amphiphilic compounds for sequential monolayer deposition | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-03-11 | — | — | EP | disclosed |