Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 6/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL10620662 | 0.95 | SIGMAR1 (0.67) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD | |
| Formaldehyde SCHEMBL28015893 | 0.88 | SIGMAR1 (0.48) | SIGMAR1NPC1RAB9ASMN1; SMN2LMNA | |
| Formaldehyde SCHEMBL28015341 | 0.86 | SIGMAR1 (0.46) | SIGMAR1SMN1; SMN2LMNACTSDKMT2A | |
| Formaldehyde SCHEMBL28015895 | 0.82 | KCNH2 (0.42) | SIGMAR1RAB9ASMN1; SMN2LMNAMEN1 | |
| SCHEMBL28252517 | 0.75 | ALDH1A1 (0.49) | SIGMAR1SMN1; SMN2HPGDLMNANOS3 | |
| SCHEMBL19050476 | 0.75 | SIGMAR1 (0.67) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL28293590 | 0.75 | SIGMAR1 (0.67) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL9159989 | 0.74 | NPC1 (0.45) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL28192155 | 0.74 | SIGMAR1 (0.56) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL6258947 | 0.73 | SIGMAR1 (0.65) | SIGMAR1NPC1RAB9ASMN1; SMN2HPGD |
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-104744379-B | A kind of quianzolinones and its synthetic method | 三峡大学 | 2017-10-27 | — | — | CN | disclosed |
| CN-104744379-A | Quinazolinone compound and synthetic method thereof | UNIV CHINA THREE GORGES CTGU | 2015-07-01 | — | — | CN | disclosed |