Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.68 |
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.68 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7915502 | 0.89 | TMEM97 (0.60) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL9827447 | 0.86 | RAB9A (0.60) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL7919653 | 0.82 | TMEM97 (0.62) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL7916125 | 0.82 | HDAC3 (0.60) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL11024162 | 0.82 | RAB9A (1.00) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL3570124 | 0.81 | LMNA (0.65) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL9149818 | 0.80 | TMEM97 (0.59) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| Hydrochloric Acid SCHEMBL9053101 | 0.80 | LMNA (0.66) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL17372434 | 0.79 | SIGMAR1 (1.00) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 | |
| SCHEMBL9826975 | 0.79 | SIGMAR1 (0.70) | RAB9ASMN1; SMN2NPC1TAAR1TMEM97 |
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-2016008011-A1 | FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS | Novogen ltd (AU) | 2016-01-21 | — | — | WO | disclosed |