Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 9/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL5593252 | 1.00 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL9841027 | 0.87 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL17861033 | 0.81 | ALDH1A1 (0.49) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL1531342 | 0.81 | POLB (0.68) | ALDH1A1TDP1POLBERN1SMN1; SMN2 | |
| SCHEMBL6819221 | 0.81 | POLB (0.68) | ALDH1A1TDP1POLBERN1SMN1; SMN2 | |
| SCHEMBL22714337 | 0.81 | HTT (0.61) | ALDH1A1TDP1POLBSLC2A1ERN1 | |
| SCHEMBL1531344 | 0.81 | POLB (0.68) | ALDH1A1TDP1POLBERN1SMN1; SMN2 | |
| SCHEMBL10552623 | 0.81 | HTT (0.61) | ALDH1A1TDP1POLBSLC2A1ERN1 | |
| SCHEMBL16951988 | 0.81 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL4272508 | 0.80 | POLB (0.66) | ALDH1A1TDP1POLBERN1SMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007075896-A2 | HETEROCYCLIC CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2007-07-05 | — | — | WO | disclosed |
| CN-1146203-A | Pyrimidinyl aryl ketone oximes | UNIROYAL CHEM CO INC (US) | 1997-03-26 | — | — | CN | disclosed |
| US-5486521-A | INSECTICIDES | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1995025725-A1 | PYRIMIDINYL ARYL KETONE OXIMES | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1995-09-28 | — | — | WO | disclosed |