Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.73 |
| ▸ | NPC1 | O15118 | 2/20 | 0.73 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.68 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL10076300 | 0.89 | RAB9A (0.77) | RAB9ASMN1; SMN2NPC1KCNK3TRPV1 | |
| SCHEMBL8252721 | 0.85 | RAB9A (1.00) | RAB9ASMN1; SMN2NPC1TRPV1LMNA | |
| SCHEMBL22983352 | 0.83 | ALDH1A1 (0.84) | RAB9ASMN1; SMN2NPC1KCNK3TSHR | |
| SCHEMBL12314962 | 0.83 | KCNK9 (0.69) | RAB9ASMN1; SMN2NPC1KCNK3HTT | |
| SCHEMBL9979193 | 0.82 | ALDH1A1 (0.62) | RAB9ASMN1; SMN2NPC1KCNK3LMNA | |
| SCHEMBL259177 | 0.82 | TDP1 (0.78) | RAB9ASMN1; SMN2NPC1KCNK3TSHR | |
| SCHEMBL3637836 | 0.82 | HDAC3 (0.65) | RAB9ASMN1; SMN2NPC1KCNK3TSHR | |
| SCHEMBL882779 | 0.82 | KCNK3 (0.69) | RAB9ASMN1; SMN2NPC1KCNK3TSHR | |
| SCHEMBL13766306 | 0.81 | SMN1; SMN2 (0.58) | SMN1; SMN2TRPV1TSHRHTTLMNA | |
| SCHEMBL8376717 | 0.81 | NPC1 (0.72) | RAB9ASMN1; SMN2NPC1TRPV1TSHR |
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-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |