Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G10 | O15496 | 1/20 | 0.50 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.50 |
| ▸ | PARP10 | Q53GL7 | 6/20 | 0.48 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.42 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.42 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL3367595 | 0.82 | ALDH1A1 (0.63) | ALDH1A1KMT2ASMN1; SMN2KDM4EMEN1 | |
| SCHEMBL7149167 | 0.79 | PLA2G10 (0.53) | PLA2G10PLA2G2APARP10PARP4PARP1 | |
| SCHEMBL14836038 | 0.79 | CYP3A4 (0.42) | CA2ALDH1A1CYP3A4TSHRCYP2C19 | |
| SCHEMBL28151928 | 0.79 | PLA2G10 (0.53) | PLA2G10PLA2G2APARP10PARP4PARP1 | |
| SCHEMBL4134122 | 0.79 | CA2 (0.64) | PLA2G10PLA2G2APARP10PARP4PARP1 | |
| SCHEMBL7149195 | 0.79 | ALDH1A1 (0.52) | CA2ALDH1A1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL178439 | 0.79 | ALDH1A1 (0.64) | PLA2G10PLA2G2APARP10PARP4PARP1 | |
| SCHEMBL2149872 | 0.78 | KMT2A (0.41) | ALDH1A1KMT2ANPC1RAB9APOLB | |
| Urea SCHEMBL6171504 | 0.78 | CES1 (0.52) | ALDH1A1KMT2ASMN1; SMN2MEN1TSHR | |
| SCHEMBL21898924 | 0.77 | KDM4E (0.43) | ALDH1A1KMT2AKDM4ENPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0329464-A2 | System for the closed-loop administration of an exercise simulating agent | GENSIA, INC. (US) | 1989-08-23 | — | — | EP | disclosed |
| EP-0007205-A1 | Optically active phenethanolamines, their formulations, use and preparation | ELI LILLY AND COMPANY (US) | 1980-01-23 | — | — | EP | disclosed |