Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.64 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.47 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541971 | 0.83 | APEX1 (0.75) | APEX1POLBTP53HSD17B10MCOLN3 | |
| SCHEMBL8544209 | 0.83 | APEX1 (0.75) | APEX1POLBTP53HSD17B10MCOLN3 | |
| SCHEMBL1001249 | 0.82 | APEX1 (0.73) | APEX1POLBKMT2ATP53HSD17B10 | |
| SCHEMBL11179367 | 0.81 | TSHR (0.69) | AKR1C3KMT2AMEN1HSD17B10KDM4E | |
| SCHEMBL1645604 | 0.81 | APEX1 (0.72) | APEX1POLBKMT2AMEN1TP53 | |
| SCHEMBL8540322 | 0.80 | POLB (0.73) | APEX1POLBKMT2AMEN1KDM4E | |
| SCHEMBL8540145 | 0.80 | APEX1 (0.70) | APEX1POLBKMT2AMEN1TP53 | |
| SCHEMBL25705600 | 0.74 | APEX1 (0.65) | APEX1POLBKMT2AMEN1TP53 | |
| Ethyl Acetate SCHEMBL9031428 | 0.74 | KMT2A (0.65) | APEX1POLBKMT2AMEN1MCOLN3 | |
| SCHEMBL8544818 | 0.74 | AKR1C3 (0.44) | AKR1C3POLBHSD17B10MCOLN3GPBAR1 |
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-0705259-B1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-02-25 | — | — | EP | disclosed |
| EP-0741721-A1 | PHENYLPYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-11-13 | — | — | EP | disclosed |
| WO-1995021165-A1 | PHENYLPYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-08-10 | — | — | WO | disclosed |