Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CASP6 | P55212 | 2/20 | 0.46 |
| ▸ | DNA2 | P51530 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL9079253 | 0.91 | CDK2 (0.47) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL2870921 | 0.83 | TSHR (0.62) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL9080086 | 0.81 | KMT2A (0.46) | TSHRALDH1A1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL4442634 | 0.79 | TSHR (0.56) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL31401808 | 0.79 | TSHR (0.56) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL30991605 | 0.79 | TSHR (0.56) | CDK2TSHRALDH1A1CASP6DNA2 | |
| SCHEMBL11314439 | 0.79 | TSHR (0.56) | CDK2TSHRALDH1A1CASP6DNA2 | |
| SCHEMBL11422869 | 0.78 | CDK2 (0.50) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL28638357 | 0.78 | CDK2 (0.56) | CDK2TSHRPOLBALDH1A1CASP6 | |
| SCHEMBL11808349 | 0.77 | TDP1 (0.55) | CDK2TSHRPOLBALDH1A1CASP6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995000490-A1 | BIS-IMIDE POLYCYCLIC AND HETEROCYCLIC CHROMOPHORES USEFUL AS TUMORICIDALS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-01-05 | — | — | WO | disclosed |