Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL17758471 | 0.90 | SMPD1 (0.63) | ROCK2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17676475 | 0.88 | LMNA (0.54) | TP53NPC1RAB9ATMEM97SIGMAR1 | |
| SCHEMBL930908 | 0.88 | ROCK2 (0.76) | ROCK2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17758477 | 0.86 | TMEM97 (0.58) | TP53NPC1RAB9ASMN1; SMN2TMEM97 | |
| SCHEMBL14340547 | 0.85 | TAS1R3 (0.64) | ROCK2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24021265 | 0.85 | POLB (0.70) | TP53NPC1RAB9ASMN1; SMN2SMPD1 | |
| SCHEMBL24021268 | 0.84 | TLR7 (0.61) | ROCK2TP53NPC1RAB9ASMPD1 | |
| SCHEMBL8324748 | 0.84 | TAS1R3 (0.64) | ROCK2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8324517 | 0.84 | TAS1R3 (0.65) | ROCK2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17758615 | 0.83 | SLC6A2 (0.56) | TP53SMPD1MEN1KMT2AHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016077378-A1 | SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN | GENENTECH, INC. (US) | 2016-05-19 | — | — | WO | disclosed |