Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | GRM8 | O00222 | 1/20 | 0.50 |
| ▸ | GRM6 | O15303 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.50 |
| ▸ | ACP3 | P15309 | 2/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | GRM1 | Q13255 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3621002 | 1.00 | PTGS2 (0.59) | PTGS2HSD17B10TDP1MEN1CYP2C9 | |
| SCHEMBL8238614 | 1.00 | PTGS2 (0.59) | PTGS2HSD17B10TDP1MEN1CYP2C9 | |
| Hydrochloric Acid SCHEMBL2745696 | 0.98 | PTGS2 (0.57) | PTGS2HSD17B10TDP1MEN1CYP2C9 | |
| Phenylglycine SCHEMBL30559595 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL157180 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL31402004 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL27801493 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL11576917 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL159420 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A | |
| Phenylglycine SCHEMBL71958 | 0.86 | CYP2D6 (0.56) | HSD17B10TDP1MEN1CYP2C9KMT2A |
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-2012051663-A1 | ANTIMICROBIAL COMPOUNDS | MONASH UNIVERSITY (AU) | 2012-04-26 | — | — | WO | disclosed |
| WO-2010130007-A1 | ANTIMICROBIAL COMPOUNDS | MONASH UNIVERSITY (AU) | 2010-11-18 | — | — | WO | disclosed |