Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.50 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.50 |
| ▸ | ITGAV | P06756 | 1/20 | 0.50 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15630998 | 0.86 | AGER (0.47) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27419805 | 0.85 | BACE1 (0.50) | MEN1KMT2AITGB3ITGB1ITGAV | |
| SCHEMBL13992226 | 0.84 | BACE1 (0.68) | POLBMEN1KMT2ABACE1MAPT | |
| SCHEMBL18181886 | 0.83 | KDM4E (0.70) | CYP2C19POLBMEN1KMT2AKDM4E | |
| SCHEMBL11359223 | 0.82 | CYP2C19 (0.56) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4952951 | 0.81 | LMNA (0.63) | POLBNPC1RAB9AMEN1KMT2A | |
| SCHEMBL7345812 | 0.81 | BACE1 (0.47) | MEN1KMT2AITGB3ITGB1ITGAV | |
| SCHEMBL31448014 | 0.80 | KEAP1 (0.62) | RAB9AKMT2AKDM4EKEAP1MAPT | |
| SCHEMBL8768375 | 0.80 | HPGD (0.51) | RAB9AITGB3ITGB1ITGAVITGA5 | |
| SCHEMBL17087190 | 0.80 | KEAP1 (0.51) | RAB9AMEN1KMT2AITGB3ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020055951-A1 | RADIOLABELED PABA AND DERIVATIVES THEREOF FOR USE AS FUNCTIONAL RENAL IMAGING AGENTS | THE JOHNS HOPKINS UNIVERSITY (US) | 2020-03-19 | — | — | WO | claimed |