Known targets — ChEMBL curated mechanism
ADRB1CDK4CDK6CHRM2CHRM3DPP4DRD2DRD3DRD4EGFRHRH1HTR1BHTR1DHTR1FHTR2AHTR2CHTR4SLC6A2SLC6A4
The experimentally established mechanism targets of 2-(Aminomethyl)Phenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 known ✓ | P27487 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| 2-(Aminomethyl)Phenol SCHEMBL22265890 | 0.86 | AKR1B1 (0.57) | AKR1B1TAAR1HSPA5IDO1HIF1A | |
| 2-(Aminomethyl)Phenol SCHEMBL110156 | 0.85 | — | — | |
| 2-(Aminomethyl)Phenol SCHEMBL3572029 | 0.83 | TAAR1 (0.62) | AKR1B1TAAR1HSPA5IDO1ALDH1A1 | |
| 2-(Aminomethyl)Phenol SCHEMBL3460483 | 0.83 | TAAR1 (0.62) | AKR1B1TAAR1HSPA5IDO1ALDH1A1 | |
| 2-(Aminomethyl)Phenol SCHEMBL29011592 | 0.81 | TAAR1 (0.56) | AKR1B1TAAR1HSPA5IDO1HIF1A | |
| 2-(Aminomethyl)Phenol SCHEMBL10507402 | 0.81 | TAAR1 (0.60) | AKR1B1TAAR1HSPA5IDO1ALDH1A1 | |
| 2-(Aminomethyl)Phenol SCHEMBL27564882 | 0.81 | TAAR1 (0.60) | AKR1B1TAAR1HSPA5IDO1ALDH1A1 | |
| 2-Allylphenol SCHEMBL11362245 | 0.79 | AKR1B1 (0.55) | AKR1B1HSPA5NR4A2ALDH1A1HIF1A | |
| Adipic Acid SCHEMBL31179827 | 0.79 | HDAC3 (0.53) | ALDH1A1CYP2D6TSHRKEAP1SMN1; SMN2 | |
| Adipic Acid SCHEMBL3006134 | 0.79 | HDAC3 (0.53) | ALDH1A1CYP2D6TSHRKEAP1SMN1; SMN2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112898168-B | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2022-11-11 | — | — | CN | claimed |
| CN-112898168-A | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2021-06-04 | — | — | CN | claimed |
| CN-112898168-B | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2022-11-11 | — | — | CN | disclosed |
| CN-112898168-B | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2022-11-11 | — | — | CN | disclosed |
| CN-112898168-B | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2022-11-11 | — | — | CN | disclosed |
| CN-112898168-A | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2021-06-04 | — | — | CN | disclosed |
| CN-112898168-A | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2021-06-04 | — | — | CN | disclosed |
| CN-112898168-A | Salt of 2-hydroxybenzylamine-succinic acid and preparation method thereof | 天津大学 | 2021-06-04 | — | — | CN | disclosed |