Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.36 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.36 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1413121 | 0.74 | PTPN1 (0.44) | BCAT2HPGDTP53POLBLMNA | |
| SCHEMBL17868279 | 0.74 | MYC (0.32) | — | |
| SCHEMBL28736692 | 0.73 | KDM4E (0.34) | HPGDPOLBMEN1KMT2AALDH1A1 | |
| SCHEMBL10339864 | 0.73 | RAB9A (0.41) | BCAT2HPGDTP53POLBLMNA | |
| SCHEMBL27495602 | 0.71 | POLB (0.41) | BCAT2HPGDTP53POLBLMNA | |
| SCHEMBL9423170 | 0.68 | TSHR (0.38) | BCAT2HPGDMAPTLMNASMN1; SMN2 | |
| SCHEMBL8985178 | 0.67 | HDAC2 (0.38) | HPGDMAPTTP53POLBLMNA | |
| SCHEMBL9262918 | 0.67 | ALOX5 (0.42) | MAPTTP53POLBLMNASMN1; SMN2 | |
| SCHEMBL9271646 | 0.66 | ALOX5 (0.44) | MAPTTP53POLBLMNASMN1; SMN2 | |
| SCHEMBL28879787 | 0.66 | MEN1 (0.50) | MAPTTP53POLBLMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112300061-B | Preparation method of nitrogen-containing heterocyclic diaryl ketone compound | 大连理工大学 | 2022-02-18 | — | — | CN | disclosed |
| CN-112300061-A | Preparation method of nitrogen-containing heterocyclic diaryl ketone compound | 大连理工大学 | 2021-02-02 | — | — | CN | disclosed |