Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.47 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3881761 | 0.78 | S100A4 (0.47) | PTPN1ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL9350950 | 0.74 | NSD2 (0.59) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL6364879 | 0.74 | DNMT1 (0.44) | DNMT1ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL12236188 | 0.72 | DNMT1 (0.67) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL30362207 | 0.72 | DNMT1 (0.67) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL7122517 | 0.72 | DNMT1 (0.73) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL19230420 | 0.72 | DNMT1 (0.73) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL11052751 | 0.71 | NSD2 (0.51) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL10386728 | 0.71 | NSD2 (0.48) | NSD2OPRM1OPRD1HKDC1DNMT1 | |
| SCHEMBL9900718 | 0.70 | DNMT1 (0.70) | NSD2OPRM1OPRD1HKDC1DNMT1 |
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-4036838-A | Process for the production of nitro derivatives of aromatic compounds | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-19 | — | — | US | disclosed |