Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29598509 | 0.88 | CYP1A2 (0.44) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL29598646 | 0.86 | CYP1A2 (0.70) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL29235834 | 0.84 | CYP1A2 (0.56) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL1536431 | 0.83 | CYP1A2 (0.69) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL29235432 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL10465516 | 0.82 | CYP1A2 (0.64) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL10465572 | 0.80 | L3MBTL1 (0.63) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL29597771 | 0.80 | CYP1A2 (0.42) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL29598561 | 0.79 | CYP1A2 (0.41) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A | |
| SCHEMBL1816233 | 0.79 | CYP1A2 (0.71) | CYP1A2CYP2C19SMN1; SMN2GAARAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1023700-C | Aromatic and heterocyclic carboxamide derivatives as antineoplastic agents | PFIZER (US) | 1994-02-09 | — | — | CN | disclosed |
| EP-0343893-B1 | AROMATIC AND HETEROCYCLIC CARBOXAMIDE DERIVATIVES AS ANTINEOPLASTIC AGENTS | PFIZER INC. (US) | 1992-08-05 | — | — | EP | disclosed |
| US-4970318-A | ANTICARBINOGENIC AGENTS | PFIZER INC. (US) | 1990-11-13 | — | — | US | disclosed |
| CN-1037898-A | The preparation of aromatics and Heterocyclylcarboxamderivatives derivatives antineoplastic agent | PFIZER (US) | 1989-12-13 | — | — | CN | disclosed |
| EP-0343893-A1 | Aromatic and heterocyclic carboxamide derivatives as antineoplastic agents | PFIZER INC. (US) | 1989-11-29 | — | — | EP | disclosed |