Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| Anisole SCHEMBL8850339 | 0.89 | CA4 (0.64) | CA4LTA4HSMN1; SMN2ALDH1A1TSHR | |
| Anisole SCHEMBL9859483 | 0.87 | CA4 (0.61) | CA4LTA4HSMN1; SMN2ALDH1A1TSHR | |
| Anisole SCHEMBL9436549 | 0.87 | CA4 (0.61) | CA4LTA4HSMN1; SMN2ALDH1A1TSHR | |
| Anisole SCHEMBL9798277 | 0.84 | CA4 (0.70) | CA4LTA4HALDH1A1SIGMAR1L3MBTL1 | |
| Anisole SCHEMBL5188448 | 0.84 | CA4 (0.70) | CA4LTA4HALDH1A1SIGMAR1L3MBTL1 | |
| Anisole SCHEMBL10685829 | 0.82 | CA4 (0.67) | CA4LTA4HALDH1A1SIGMAR1L3MBTL1 | |
| Benzene SCHEMBL11181513 | 0.82 | ALDH1A1 (0.42) | ALDH1A1TSHRHTT | |
| Toluene SCHEMBL14675705 | 0.81 | LMNA (0.42) | ALDH1A1TSHRNPSR1ICMTLMNA | |
| Anisole SCHEMBL2223673 | 0.80 | CA4 (0.70) | CA4LTA4HSMN1; SMN2SIGMAR1L3MBTL1 | |
| Bromobenzene SCHEMBL29291356 | 0.80 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1TSHRNPSR1GAA |
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-2265698-A1 | VELAR BIO HYDROCARBON FUEL | Ponnupillai, Ramar (IN) | 2010-12-29 | — | — | EP | disclosed |
| WO-2009113080-A1 | VELAR BIO HYDROCARBON FUEL | PONNUPILLAI RAMAR (IN) | 2009-09-17 | — | — | WO | disclosed |