Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | EP300 | Q09472 | 1/20 | 0.43 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.43 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Butylbenzyl SCHEMBL8519397 | 0.86 | HTR2A (0.53) | HTR2AKCNH2RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL27670849 | 0.83 | KCNH2 (0.57) | HTR2AKCNH2SIGMAR1EP300KAT5 | |
| Butylbenzyl SCHEMBL27330531 | 0.82 | ALDH1A1 (0.52) | KCNH2SMN1; SMN2SIGMAR1ALDH1A1CHRM2 | |
| Isopropylbenzene SCHEMBL1451620 | 0.82 | CRHBP (0.46) | SMN1; SMN2KMT2ASLC6A2SLC6A4LMNA | |
| Isopropylbenzene SCHEMBL27747785 | 0.82 | CRHBP (0.46) | SMN1; SMN2KMT2ASLC6A2SLC6A4LMNA | |
| Isobutane SCHEMBL28163284 | 0.80 | KCNH2 (0.61) | HTR2AKCNH2SIGMAR1ALDH1A1CHRM2 | |
| Isopropylbenzene SCHEMBL8837125 | 0.80 | HTR2A (0.47) | HTR2AKCNH2ALDH1A1LMNA | |
| SCHEMBL6548131 | 0.79 | L3MBTL1 (0.50) | KCNH2SIGMAR1KMT2ACHRM2HTR1A | |
| SCHEMBL8091009 | 0.79 | HTR2A (0.56) | HTR2AKCNH2ALDH1A1CHRM2ADRA2A | |
| Isopropylbenzene SCHEMBL10951391 | 0.79 | SIGMAR1 (0.49) | HTR2AKCNH2RAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105793447-A | Scandium separation method | 学校法人关西大学 | 2016-07-20 | — | — | CN | disclosed |