Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.63 |
| ▸ | PLK1 | P53350 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | PIM1 | P11309 | 1/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.49 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.49 |
| ▸ | GABRB3 | P28472 | 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 | |
|---|---|---|---|---|
| SCHEMBL25300585 | 0.93 | KMO (0.56) | KMOPLK1CYP19A1MAPTMEN1 | |
| SCHEMBL28483259 | 0.93 | KMO (0.59) | KMOPLK1CYP19A1MAPTMEN1 | |
| SCHEMBL29197290 | 0.92 | KMO (0.55) | KMOPLK1CYP19A1MAPTMEN1 | |
| SCHEMBL29197190 | 0.92 | KMO (0.55) | KMOPLK1CYP19A1MAPTMEN1 | |
| SCHEMBL18134284 | 0.84 | KMT2A (0.58) | KMOMAPTMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL18134295 | 0.84 | KMT2A (0.58) | KMOMAPTMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL18731939 | 0.84 | KMT2A (0.58) | KMOMAPTMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL31119010 | 0.82 | KMO (0.62) | KMOPLK1CYP19A1MAPTSMN1; SMN2 | |
| SCHEMBL443718 | 0.82 | KMO (0.62) | KMOPLK1CYP19A1MAPTSMN1; SMN2 | |
| SCHEMBL28319645 | 0.82 | KMT2A (0.72) | KMOCYP19A1MAPTMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111961004-B | Method for preparing medical intermediate 2, 4, 6-triaryl pyrimidine derivative through catalysis | 马鞍山市泰博化工科技有限公司 | 2021-11-12 | — | — | CN | disclosed |
| CN-111961004-A | Method for preparing medical intermediate 2, 4, 6-triaryl pyrimidine derivative through catalysis | 马鞍山市泰博化工科技有限公司 | 2020-11-20 | — | — | CN | disclosed |