Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.44 |
| ▸ | CPN1 | P15169 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.35 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15618893 | 0.86 | — | — | |
| SCHEMBL31572346 | 0.82 | THRB (0.44) | SLC6A3MMP2TSHRTHRBTP53 | |
| SCHEMBL2554561 | 0.82 | TP53 (0.47) | SLC6A3MMP2TSHRTHRBTP53 | |
| SCHEMBL5265181 | 0.81 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3CPN1CPB2 | |
| SCHEMBL1605366 | 0.80 | TP53 (0.50) | SLC6A3EPHX1MMP2TSHRTHRB | |
| SCHEMBL20740436 | 0.80 | TP53 (0.50) | SLC6A3EPHX1MMP2TSHRTHRB | |
| SCHEMBL14218540 | 0.80 | TP53 (0.50) | SLC6A3EPHX1MMP2TSHRTHRB | |
| SCHEMBL1037114 | 0.78 | SLC6A3 (0.46) | SLC6A2SLC6A4SLC6A3CPN1CPB2 | |
| SCHEMBL18307376 | 0.78 | SLC6A3 (0.46) | SLC6A2SLC6A4SLC6A3CPN1CPB2 | |
| SCHEMBL27687987 | 0.78 | CPN1 (0.33) | SLC6A2SLC6A4SLC6A3CPN1CPB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010080873-A1 | OXAZOLES AS MODULATORS OF CHEMOKINE RECEPTORS | GLAXO GROUP LIMITED (GB) | 2010-07-15 | — | — | WO | disclosed |
| EP-1802602-A1 | SUBSTITUTED DIPIPERDINE CCR2 ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-07-04 | — | — | EP | disclosed |
| WO-2006036527-A1 | SUBSTITUTED DIPIPERDINE CCR2 ANTAGONISTS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-04-06 | — | — | WO | disclosed |