Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | PTPRF | P10586 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3149356 | 0.87 | RAB9A (0.43) | RAB9AVCAM1MAPTL3MBTL1NPC1 | |
| SCHEMBL3153199 | 0.81 | RAB9A (0.51) | RAB9AVCAM1MAPTMEN1KMT2A | |
| SCHEMBL7779674 | 0.81 | RAB9A (0.51) | RAB9AVCAM1MAPTNPC1MEN1 | |
| SCHEMBL3149349 | 0.79 | RAB9A (0.74) | RAB9AVCAM1MAPTL3MBTL1MEN1 | |
| SCHEMBL894368 | 0.76 | VCAM1 (0.47) | RAB9AVCAM1MAPTPOLBLMNA | |
| SCHEMBL25352613 | 0.73 | VCAM1 (0.44) | RAB9AVCAM1MAPTNPC1SMN1; SMN2 | |
| SCHEMBL8313813 | 0.72 | VCAM1 (0.56) | RAB9AVCAM1MAPTHPGDALDH1A1 | |
| SCHEMBL29411983 | 0.71 | HTR6 (0.58) | MAPTL3MBTL1MEN1KMT2AUSP2 | |
| SCHEMBL894816 | 0.71 | TDP1 (0.60) | RAB9AVCAM1MAPTPOLBCYP2C9 | |
| SCHEMBL272708 | 0.71 | TDP1 (0.60) | RAB9AVCAM1MAPTHPGDEGFR |
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 |
|---|---|---|---|---|---|---|---|
| US-7687638-B2 | Dipeptidyl peptidase inhibitors | TAKEDA SAN DIEGO, INC. (US) | 2010-03-30 | — | — | US | disclosed |
| US-7687638-B2 | Dipeptidyl peptidase inhibitors | TAKEDA SAN DIEGO, INC. (US) | 2010-03-30 | — | — | US | disclosed |
| WO-2005118555-A1 | DIPEPTIDYL PEPTIDASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-12-15 | — | — | WO | disclosed |