Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2653851 | 0.79 | SMN1; SMN2 (0.59) | SMN1; SMN2NPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL11455339 | 0.77 | NPC1 (0.64) | NPC1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11455323 | 0.73 | CYP1A2 (0.57) | SMN1; SMN2NPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL10265791 | 0.71 | KDM4E (0.89) | SMN1; SMN2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL11725074 | 0.70 | ALDH1A1 (0.60) | SMN1; SMN2ALDH1A1ADORA1HPGDKDM4E | |
| SCHEMBL15546049 | 0.69 | MAPT (0.51) | ALDH1A1ADORA1HPGDKDM4EHTT | |
| SCHEMBL27965972 | 0.68 | ALDH1A1 (0.58) | SMN1; SMN2NPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL11474504 | 0.68 | NPC1 (0.55) | SMN1; SMN2NPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2655830 | 0.68 | ALDH1A1 (0.70) | SMN1; SMN2NPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL19703413 | 0.67 | HPGD (1.00) | ALDH1A1HPGDPOLBKCNK3KCNK9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4222946-A | ANTIALLERGEN, HYPERSENSITIVITY | LILLY INDUSTRIES, LIMITED (GB) | 1980-09-16 | — | — | US | disclosed |
| US-4187232-A | ANTIALLERGENS | LILLY INDUSTRIES LIMITED (GB) | 1980-02-05 | — | — | US | disclosed |