Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | VNN1 | O95497 | 3/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6221826 | 0.84 | GRM5 (0.45) | VNN1ADORA2AGRM5ALOX15ALDH1A1 | |
| SCHEMBL6221038 | 0.83 | MAPT (0.45) | VNN1ADORA2AGRM5ALDH1A1MAPT | |
| SCHEMBL8185074 | 0.82 | VNN1 (0.41) | CYP2C19VNN1ADORA2AGRM5 | |
| SCHEMBL8193773 | 0.81 | ALDH1A1 (0.41) | KMT2AMEN1VNN1GRM5CNR2 | |
| SCHEMBL8197231 | 0.81 | VNN1 (0.40) | VNN1ADORA2AGRM5ALOX15ALDH1A1 | |
| SCHEMBL6226517 | 0.81 | VNN1 (0.40) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8196200 | 0.80 | MAPT (0.40) | KMT2ACYP1A2CYP2C19NPSR1LMNA | |
| SCHEMBL6221993 | 0.79 | HPGD (0.40) | KMT2AMEN1VNN1GRM5ALDH1A1 | |
| SCHEMBL8692622 | 0.77 | MEN1 (0.48) | KMT2AMEN1VNN1KDM4EALDH1A1 | |
| SCHEMBL20256974 | 0.75 | LDHA (0.45) | ADORA1KMT2AMEN1ADORA2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6136810-A | DRUGS AS ENZYME INHIBITORS OF PHOSPHODIESTERASE | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2000-10-24 | — | — | US | disclosed |
| EP-0885894-A1 | PYRIDO [2,3-D] PYRIMIDINE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-12-23 | — | — | EP | disclosed |