Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 3/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.33 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5531426 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRKDM4ENPC1TP53 | |
| SCHEMBL30602821 | 0.76 | ALDH1A1 (0.58) | ALDH1A1TSHRNOTUMKDM4ENPC1 | |
| SCHEMBL183516 | 0.76 | ALDH1A1 (0.35) | ALDH1A1RAB9A | |
| SCHEMBL5887447 | 0.76 | HSD17B2 (0.46) | NOTUMFYN | |
| SCHEMBL8165380 | 0.76 | — | — | |
| SCHEMBL2115058 | 0.76 | ACHE (0.42) | ALDH1A1TSHRNOTUMKDM4ENPC1 | |
| SCHEMBL589437 | 0.75 | MAOA (0.41) | ALDH1A1 | |
| SCHEMBL26567 | 0.75 | MAOA (0.41) | ALDH1A1 | |
| SCHEMBL1252082 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TSHRNOTUMKDM4ENPC1 | |
| SCHEMBL10888147 | 0.74 | PSMB5 (0.38) | ALDH1A1TSHRNOTUMKDM4ENPC1 |
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-4341894-A | 2,4,6 TRI-SUBSTITUTED PYRYLIUM DYE SALTS | EASTMAN KODAK COMPANY (US) | 1982-07-27 | — | — | US | disclosed |
| US-4167412-A | COMPRISING A PYRYLIUM OR THIOPYRYLIUM SALT | EASTMAN KODAK COMPANY (US) | 1979-09-11 | — | — | US | disclosed |