Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.52 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9052566 | 0.99 | KMT2A (0.52) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| Hydrochloric Acid SCHEMBL9051788 | 0.85 | LMNA (0.39) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| Hydrochloric Acid SCHEMBL9053509 | 0.84 | SMN1; SMN2 (0.52) | KMT2AALDH1A1CYP1A2CYP2E1CYP2C8 | |
| Hydrochloric Acid SCHEMBL9051713 | 0.83 | OPRL1 (0.39) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| SCHEMBL9052994 | 0.80 | MAPT (0.60) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| SCHEMBL9053557 | 0.79 | ALDH1A1 (0.51) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| Hydrochloric Acid SCHEMBL9052734 | 0.78 | CYP1A2 (0.37) | KMT2AMAPTCYP1A2CYP2E1CYP2C8 | |
| SCHEMBL9279489 | 0.77 | RAB9A (0.65) | KMT2AALDH1A1MAPTMEN1KDM4E | |
| SCHEMBL7807341 | 0.74 | NPC1 (0.58) | KMT2AALDH1A1MAPTMEN1CYP1A2 | |
| SCHEMBL6141660 | 0.72 | BCHE (0.83) | KMT2AALDH1A1MAPTMEN1LMNA |
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-1996000224-A1 | 4-S- AND N-SUBSTITUTED 6-ALKYLPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1996-01-04 | — | — | WO | disclosed |