Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | EGFR | P00533 | 1/20 | 0.61 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TDP2 | O95551 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 2/20 | 0.47 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PTPRC | P08575 | 3/20 | 0.46 |
| ▸ | S100A4 | P26447 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL151957 | 0.78 | CYP3A4 (1.00) | TDP1CYP3A4EGFRSMN1; SMN2CA9 | |
| SCHEMBL27798142 | 0.76 | CYP3A4 (0.96) | TDP1CYP3A4EGFRSMN1; SMN2CA9 | |
| Methane SCHEMBL28326322 | 0.76 | CYP3A4 (0.96) | TDP1CYP3A4EGFRSMN1; SMN2CA9 | |
| SCHEMBL8525618 | 0.76 | EGFR (0.38) | TDP1CYP3A4EGFRSMN1; SMN2CA9 | |
| SCHEMBL10943739 | 0.75 | HPRT1 (0.74) | TDP1CYP3A4EGFRHPRT1CA9 | |
| SCHEMBL11588993 | 0.75 | HPRT1 (0.69) | TDP1CYP3A4EGFRHPRT1SMN1; SMN2 | |
| SCHEMBL8524149 | 0.73 | GSK3B (0.52) | TDP1CYP3A4EGFRSMN1; SMN2MEN1 | |
| SCHEMBL11586212 | 0.73 | HPRT1 (0.70) | TDP1CYP3A4EGFRHPRT1CA9 | |
| SCHEMBL3134182 | 0.72 | TDP1 (0.74) | TDP1CYP3A4EGFRSMN1; SMN2CA9 | |
| SCHEMBL7048281 | 0.72 | HPRT1 (0.53) | TDP1CYP3A4EGFRHPRT1CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5962658-A | (3-oxoisoindolin-1-ylidine)propandinitrile derivatives and method for preparing the same | SAMSUNG ELECTRONICS CO., LTD. (KR) | 1999-10-05 | — | — | US | disclosed |