Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | MMP7 | P09237 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044715 | 0.90 | MMP1 (0.34) | TACR2FAAHTRPV1KDM4EMEN1 | |
| SCHEMBL4050955 | 0.86 | CTSK (0.37) | FAAHTRPV1 | |
| SCHEMBL4045182 | 0.84 | KCNQ1 (0.37) | KDM4EMEN1CYP1A2RECQLKMT2A | |
| SCHEMBL4050428 | 0.83 | HPGD (0.33) | TACR2FAAHTRPV1KDM4EMEN1 | |
| SCHEMBL4040665 | 0.83 | HPGD (0.38) | TACR2FAAHTRPV1KDM4EMEN1 | |
| SCHEMBL4042300 | 0.82 | CTSK (0.37) | — | |
| SCHEMBL4043929 | 0.82 | CTSV (0.32) | — | |
| SCHEMBL4045162 | 0.82 | TAS1R3 (0.34) | — | |
| SCHEMBL4046100 | 0.81 | KLK7 (0.35) | TACR2FAAHTRPV1KDM4EMEN1 | |
| SCHEMBL4042598 | 0.81 | CTSK (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1662876-A4 | NOVEL CRYSTALLINE FORMS OF A PHOSPHORIC ACID SALT OF A DIPEPTIDYL PEPTIDASE-IV INHIBITOR | MERCK & CO INC (US) | 2009-01-14 | — | — | EP | claimed |
| JP-2007504230-A | — | — | 2007-03-01 | — | — | JP | claimed |
| EP-1662876-A2 | NOVEL CRYSTALLINE FORMS OF A PHOSPHORIC ACID SALT OF A DIPEPTIDYL PEPTIDASE-IV INHIBITOR | Merck & Co., Inc. (US) | 2006-06-07 | — | — | EP | claimed |
| WO-2005020920-A2 | NOVEL CRYSTALLINE FORMS OF A PHOSPHORIC ACID SALT OF A DIPEPTIDYL PEPTIDASE-IV INHIBITOR | MERCK & CO., INC. (US) | 2005-03-10 | — | — | WO | claimed |