Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.67 |
| ▸ | NPC1 | O15118 | 8/20 | 0.67 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.56 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.56 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.56 |
| ▸ | GRM5 | P41594 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.51 |
| ▸ | PKM | P14618 | 4/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CCR1 | P32246 | 1/20 | 0.50 |
| ▸ | CCR5 | P51681 | 1/20 | 0.50 |
| ▸ | CCR8 | P51685 | 1/20 | 0.50 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL4322423 | 0.85 | CYP2A6 (0.60) | RAB9ANPC1GRM5SMN1; SMN2PKM | |
| SCHEMBL4188765 | 0.84 | HSD17B1 (0.64) | RAB9ANPC1GRM5SMN1; SMN2PKM | |
| SCHEMBL4322362 | 0.81 | RAB9A (0.61) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4188094 | 0.81 | GRM5 (0.63) | GRM5CYP2C9CYP2C19 | |
| 3,5-Diphenylisoxazole SCHEMBL1421260 | 0.81 | NPC1 (1.00) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL8258186 | 0.79 | NPC1 (0.96) | RAB9ANPC1CASP3SENP8SENP7 | |
| Biphenyl SCHEMBL3361226 | 0.76 | KDM4E (0.78) | RAB9ANPC1SMN1; SMN2PKMTP53 | |
| SCHEMBL4046101 | 0.74 | KDM4E (0.54) | RAB9ANPC1GRM5SMN1; SMN2PKM | |
| SCHEMBL3789967 | 0.74 | KDM4E (0.54) | RAB9ANPC1GRM5SMN1; SMN2PKM | |
| SCHEMBL30455909 | 0.74 | KDM4E (0.54) | RAB9ANPC1GRM5SMN1; SMN2PKM |
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-1993019062-A1 | TETRAHYDROPYRIDINE ISOXAZOLINE DERIVATIVES | WARNER-LAMBERT COMPANY (US) | 1993-09-30 | — | — | WO | disclosed |