Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14918993 | 0.83 | KDM4E (0.71) | KDM4EL3MBTL1KMT2ACYP1A2MAPK1 | |
| SCHEMBL31620653 | 0.83 | GRM5 (0.49) | GRM5KMT2ACYP1A2MAPK1MRGPRX4 | |
| SCHEMBL6508659 | 0.83 | P2RX7 (0.53) | KDM4EL3MBTL1MAPK1TDP1NPC1 | |
| SCHEMBL26810299 | 0.81 | SMN1; SMN2 (0.49) | KDM4EL3MBTL1MAPK1MRGPRX4TDP1 | |
| SCHEMBL16372480 | 0.79 | KDM4E (0.42) | KDM4EL3MBTL1GRM5KMT2AMAPK1 | |
| SCHEMBL9089861 | 0.78 | MAPK1 (0.44) | KDM4EL3MBTL1GRM5KMT2ACYP1A2 | |
| SCHEMBL11894231 | 0.77 | KDM4E (0.50) | KDM4EL3MBTL1KMT2ACYP1A2MAPK1 | |
| SCHEMBL31691379 | 0.77 | IAPP (0.47) | KDM4EL3MBTL1GRM5KMT2ACYP1A2 | |
| SCHEMBL8280799 | 0.76 | KDM4E (0.43) | KDM4EL3MBTL1KMT2AMAPK1TDP1 | |
| SCHEMBL1161278 | 0.75 | MAPT (0.48) | KDM4EL3MBTL1KMT2ACYP1A2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005082866-A2 | SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-09-09 | — | — | WO | disclosed |
| WO-2005082866-A2 | SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-09-09 | — | — | WO | disclosed |