Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 1.00 |
| ▸ | CYP3A4 | P08684 | 3/20 | 1.00 |
| ▸ | TP53 | P04637 | 3/20 | 1.00 |
| ▸ | HPGD | P15428 | 3/20 | 1.00 |
| ▸ | HIF1A | Q16665 | 2/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 1.00 |
| ▸ | MAPT | P10636 | 3/20 | 0.77 |
| ▸ | APEX1 | P27695 | 2/20 | 0.77 |
| ▸ | POLB | P06746 | 1/20 | 0.77 |
| ▸ | CASP6 | P55212 | 1/20 | 0.77 |
| ▸ | CSNK2A2 | P19784 | 3/20 | 0.75 |
| ▸ | CSNK2B | P67870 | 3/20 | 0.75 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.75 |
| ▸ | CSNK2A3 | Q8NEV1 | 3/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CTSB | P07858 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10356103 | 1.00 | TSHR (1.00) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL3501895 | 1.00 | TSHR (1.00) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL186885 | 1.00 | TSHR (1.00) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL10356144 | 1.00 | TSHR (1.00) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL27988174 | 0.98 | TSHR (0.96) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL27988713 | 0.98 | TSHR (0.96) | TSHRCYP3A4TP53HPGDHIF1A | |
| Water SCHEMBL28089537 | 0.96 | TSHR (0.92) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL11705536 | 0.89 | TSHR (0.80) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL848506 | 0.89 | TSHR (0.80) | TSHRCYP3A4TP53HPGDHIF1A | |
| SCHEMBL10400291 | 0.89 | HPGD (0.80) | TSHRCYP3A4TP53HPGDHIF1A |
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-4115652-A | Process for the preparation of amino-nitrophenols | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-19 | — | — | US | disclosed |