Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | F13A1 | P00488 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | TGM1 | P22735 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10256309 | 0.89 | RAB9A (0.55) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL10255275 | 0.86 | GRM5 (0.50) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL2497238 | 0.85 | LMNA (0.60) | GRM5RAB9ANPC1TSHRL3MBTL1 | |
| SCHEMBL616029 | 0.84 | GRM5 (0.51) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL10255288 | 0.83 | GRM5 (0.57) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL10255410 | 0.80 | GRM5 (0.51) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL10255402 | 0.80 | KDM4E (0.58) | GRM5POLBALDH1A1KDM4EKMT2A | |
| SCHEMBL10257099 | 0.79 | GRM5 (0.50) | GRM5RAB9ATSHRGAALMNA | |
| SCHEMBL10255321 | 0.76 | GRM5 (0.56) | GRM5RAB9ANPC1TSHRHTT | |
| SCHEMBL14822725 | 0.75 | GRM5 (0.55) | GRM5TSHRHTTL3MBTL1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2370424-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | Vertex Pharmaceuticals Incorporated (US) | 2011-10-05 | — | — | EP | disclosed |