Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| Aniline SCHEMBL28133746 | 0.94 | TSHR (0.46) | CYP3A4TDP1HSD17B10TAAR1TSHR | |
| Biphenyl SCHEMBL27961596 | 0.86 | ALDH1A1 (0.41) | HSD17B10ALDH1A1SMN1; SMN2MAPTL3MBTL1 | |
| Aniline SCHEMBL28136467 | 0.84 | HSD17B10 (0.37) | CYP3A4HSD17B10TSHRMAOAALDH1A1 | |
| Ethoxycarbonyl Group SCHEMBL27558742 | 0.84 | DHODH (0.40) | HSD17B10TAAR1ALDH1A1SMN1; SMN2MAPT | |
| Ethoxycarbonyl Group SCHEMBL28591716 | 0.81 | CYP3A4 (0.50) | CYP3A4TDP1TSHRMAOAALDH1A1 | |
| Aniline SCHEMBL28281247 | 0.79 | TSHR (0.42) | CYP3A4TDP1HSD17B10TSHRMAOA | |
| Ethoxycarbonyl Group SCHEMBL28035121 | 0.77 | TAAR1 (0.38) | TAAR1TSHRALDH1A1SMN1; SMN2MAPT | |
| Benzene SCHEMBL18406222 | 0.77 | ALDH1A1 (0.32) | TDP1HSD17B10ALDH1A1HPGDKDM4E | |
| Toluene SCHEMBL27550219 | 0.76 | TSHR (0.48) | HSD17B10TSHRALDH1A1SMN1; SMN2NPC1 | |
| Naphthalene SCHEMBL27488215 | 0.76 | ALDH1A1 (0.40) | TDP1HSD17B10TSHRALDH1A1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1091420-A | Process for the preparation of diphenylamine derivatives | YONGXIN MEDICINES AND CHEMICAL (CN) | 1994-08-31 | — | — | CN | disclosed |