Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.69 |
| ▸ | MMP9 | P14780 | 4/20 | 0.69 |
| ▸ | MMP8 | P22894 | 4/20 | 0.69 |
| ▸ | MMP1 | P03956 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | TACR2 | P21452 | 3/20 | 0.53 |
| ▸ | TACR1 | P25103 | 1/20 | 0.53 |
| ▸ | APAF1 | O14727 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7672641 | 0.94 | MMP2 (0.61) | MMP2MMP9MMP8MMP1POLB | |
| SCHEMBL7670517 | 0.85 | KDM4E (0.60) | MMP2MMP9MMP8POLBCTDSP1 | |
| SCHEMBL7678243 | 0.84 | KDM4E (0.59) | MMP2MMP9MMP8POLBCTDSP1 | |
| SCHEMBL7669483 | 0.83 | KDM4E (0.58) | MMP2MMP9MMP8MMP1POLB | |
| SCHEMBL7856142 | 0.83 | DRD2 (0.58) | MMP2MMP9MMP8POLBCTDSP1 | |
| SCHEMBL8519207 | 0.83 | MMP2 (0.70) | MMP2MMP9MMP8MMP1TACR2 | |
| SCHEMBL7590569 | 0.82 | MMP2 (1.00) | MMP2MMP9MMP8MMP1 | |
| SCHEMBL7848635 | 0.82 | POLB (0.58) | MMP2MMP9MMP8MMP1POLB | |
| SCHEMBL8700131 | 0.81 | MAPT (0.57) | MMP2MMP9MMP8MMP1POLB | |
| SCHEMBL7852477 | 0.81 | SMN1; SMN2 (0.54) | MMP2MMP9MMP8POLBCTDSP1 |
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-1140914-A1 | NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000037462-A1 | NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 2000-06-29 | — | — | WO | disclosed |